C201-0973 Screening compound: N~4~-(3,4-dimethoxyphenyl)-1-(7-methyl-9-phenylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)-4-piperidinecarboxamide

C201-0973 Screening compound: N~4~-(3,4-dimethoxyphenyl)-1-(7-methyl-9-phenylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)-4-piperidinecarboxamide
C201-0973 Screening compound: N~4~-(3,4-dimethoxyphenyl)-1-(7-methyl-9-phenylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0973
N~4~-(3,4-dimethoxyphenyl)-1-(7-methyl-9-phenylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)-4-piperidinecarboxamide

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

C201-0973

Molecular Formula

C30H29N5O3S (C30 H29 N5 O3 S)

Compound Name

N~4~-(3,4-dimethoxyphenyl)-1-(7-methyl-9-phenylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)-4-piperidinecarboxamide

IUPAC name

N-(34-dimethoxyphenyl)-1-{11-methyl-13-phenyl-8-thia-3510-triazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35911-hexaen-6-yl}piperidine-4-carboxamide

SMILES

Cc1cc(-c2ccccc2)c(c2ncnc(N(CC3)CCC3C(Nc(cc3)cc(OC)c3OC)=O)c2s2)c2n1

InChI

InChI=1S/C30H29N5O3S/c1-18-15-22(19-7-5-4-6-8-19)25-26-27(39-30(25)33-18)28(32-17-31-26)35-13-11-20(12-14-35)29(36)34-21-9-10-23(37-2)24(16-21)38-3/h4-10,15-17,20H,11-14H2,1-3H3,(H,34,36)

InChI Key

IXKJVSWGUQORCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729549

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

539.66

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.462

Distribution Coefficient, logD

5.421

Water Solubility, LogSw

-5.62

Polar Surface Area

71.527

Acid Dissociation Constant (pKa)

10.77

Base Dissociation Constant (pKb)

6.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

C201-0973 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with C201-0973 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0973?
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What is the minimum amount of C201-0973 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0973
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0973
  • 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 C201-0973 available by request