F145-0355 Screening compound: N~1~-butyl-N~1~-methyl-3-(7-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide

F145-0355 Screening compound: N~1~-butyl-N~1~-methyl-3-(7-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide
F145-0355 Screening compound: N~1~-butyl-N~1~-methyl-3-(7-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F145-0355
N~1~-butyl-N~1~-methyl-3-(7-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide

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

F145-0355

Molecular Formula

C19H27N3O2S (C19 H27 N3 O2 S)

Compound Name

N~1~-butyl-N~1~-methyl-3-(7-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide

IUPAC name

N-butyl-N-methyl-3-{11-methyl-3-oxo-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)5-trien-5-yl}propanamide

SMILES

CCCCN(C)C(CCC(N1)=Nc(sc2c3CCC(C)C2)c3C1=O)=O

InChI

InChI=1S/C19H27N3O2S/c1-4-5-10-22(3)16(23)9-8-15-20-18(24)17-13-7-6-12(2)11-14(13)25-19(17)21-15/h12H,4-11H2,1-3H3,(H,20,21,24)/t12-/m1/s1

InChI Key

LPPSTJKCYUHTPL-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD20754164

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.203

Distribution Coefficient, logD

3.202

Water Solubility, LogSw

-3.61

Polar Surface Area

50.868

Acid Dissociation Constant (pKa)

10.25

Base Dissociation Constant (pKb)

0.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.20

F145-0355 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

KRAS-Targeted Library (16000 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F145-0355 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F145-0355?
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What is the minimum amount of F145-0355 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F145-0355
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F145-0355
  • 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 F145-0355 available by request