V009-6453 Screening compound: 4-[6-(benzenesulfonyl)-2-[4-(3,4-dimethylphenyl)piperazin-1-yl]-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-yl]morpholine
Chemical Structure Depiction of ChemDiv screening compound V009-6453
4-[6-(benzenesulfonyl)-2-[4-(3,4-dimethylphenyl)piperazin-1-yl]-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-yl]morpholine
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
V009-6453
Molecular Formula
C29H36N6O3S (C29 H36 N6 O3 S)
Compound Name
4-[6-(benzenesulfonyl)-2-[4-(3,4-dimethylphenyl)piperazin-1-yl]-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-4-yl]morpholine
IUPAC name
4-[6-(benzenesulfonyl)-2-[4-(34-dimethylphenyl)piperazin-1-yl]-5H6H7H8H-pyrido[43-d]pyrimidin-4-yl]morpholine
SMILES
Cc(cc1)c(C)cc1N(CC1)CCN1c1nc(N2CCOCC2)c(CN(CC2)S(c3ccccc3)(=O)=O)c2n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
548.71
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
5.175
Distribution Coefficient, logD
5.174
Water Solubility, LogSw
-5.16
Polar Surface Area
68.617
Acid Dissociation Constant (pKa)
20.31
Base Dissociation Constant (pKb)
4.68
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
44.80
V009-6453 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Anticancer Library (62698 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
PI3K-Targeted Library (17255 compounds)
Included in 1.7M Stock Database
- Cancer
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
References: we are preparing a list of scientific research reports with V009-6453 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.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)