Screening compound: InChI=1S/C29H27N3O4S/c1-18(2)35-23-13-9-20(10-14-23)27-30-26(19(3)36-27)17-37-29-31-25-8-6-5-7-24(25)28(33)32(29)21-11-15-22(34-4)16-12-21/h5-16,18H,17H2,1-4H3

Screening compound: InChI=1S/C29H27N3O4S/c1-18(2)35-23-13-9-20(10-14-23)27-30-26(19(3)36-27)17-37-29-31-25-8-6-5-7-24(25)28(33)32(29)21-11-15-22(34-4)16-12-21/h5-16,18H,17H2,1-4H3
Screening compound: InChI=1S/C29H27N3O4S/c1-18(2)35-23-13-9-20(10-14-23)27-30-26(19(3)36-27)17-37-29-31-25-8-6-5-7-24(25)28(33)32(29)21-11-15-22(34-4)16-12-21/h5-16,18H,17H2,1-4H3 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C29H27N3O4S/c1-18(2)35-23-13-9-20(10-14-23)27-30-26(19(3)36-27)17-37-29-31-25-8-6-5-7-24(25)28(33)32(29)21-11-15-22(34-4)16-12-21/h5-16,18H,17H2,1-4H3

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

F413-0211

Molecular Formula

C29H27N3O4S (C29 H27 N3 O4 S)

Compound Name

3-(4-methoxyphenyl)-2-[({5-methyl-2-[4-(propan-2-yloxy)phenyl]-1,3-oxazol-4-yl}methyl)sulfanyl]-3,4-dihydroquinazolin-4-one

IUPAC name

3-(4-methoxyphenyl)-2-[({5-methyl-2-[4-(propan-2-yloxy)phenyl]-13-oxazol-4-yl}methyl)sulfanyl]-34-dihydroquinazolin-4-one

SMILES

CC(C)Oc(cc1)ccc1-c1nc(CSC(N2c(cc3)ccc3OC)=Nc(cccc3)c3C2=O)c(C)o1

InChI

InChI=1S/C29H27N3O4S/c1-18(2)35-23-13-9-20(10-14-23)27-30-26(19(3)36-27)17-37-29-31-25-8-6-5-7-24(25)28(33)32(29)21-11-15-22(34-4)16-12-21/h5-16,18H,17H2,1-4H3

InChI Key

RQNUEOGXVNQITE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14953911

InChI=1S/C29H27N3O4S/c1-18(2)35-23-13-9-20(10-14-23)27-30-26(19(3)36-27)17-37-29-31-25-8-6-5-7-24(25)28(33)32(29)21-11-15-22(34-4)16-12-21/h5-16,18H,17H2,1-4H3 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with InChI=1S/C29H27N3O4S/c1-18(2)35-23-13-9-20(10-14-23)27-30-26(19(3)36-27)17-37-29-31-25-8-6-5-7-24(25)28(33)32(29)21-11-15-22(34-4)16-12-21/h5-16,18H,17H2,1-4H3 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for InChI=1S/C29H27N3O4S/c1-18(2)35-23-13-9-20(10-14-23)27-30-26(19(3)36-27)17-37-29-31-25-8-6-5-7-24(25)28(33)32(29)21-11-15-22(34-4)16-12-21/h5-16,18H,17H2,1-4H3
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for InChI=1S/C29H27N3O4S/c1-18(2)35-23-13-9-20(10-14-23)27-30-26(19(3)36-27)17-37-29-31-25-8-6-5-7-24(25)28(33)32(29)21-11-15-22(34-4)16-12-21/h5-16,18H,17H2,1-4H3
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of InChI=1S/C29H27N3O4S/c1-18(2)35-23-13-9-20(10-14-23)27-30-26(19(3)36-27)17-37-29-31-25-8-6-5-7-24(25)28(33)32(29)21-11-15-22(34-4)16-12-21/h5-16,18H,17H2,1-4H3 available by request