V027-2173 Screening compound: 2,4-dichloro-N-[(2Z)-4,5-dimethyl-3-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}-2,3-dihydro-1,3-thiazol-2-ylidene]benzamide

V027-2173 Screening compound: 2,4-dichloro-N-[(2Z)-4,5-dimethyl-3-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}-2,3-dihydro-1,3-thiazol-2-ylidene]benzamide
V027-2173 Screening compound: 2,4-dichloro-N-[(2Z)-4,5-dimethyl-3-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}-2,3-dihydro-1,3-thiazol-2-ylidene]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-2173
2,4-dichloro-N-[(2Z)-4,5-dimethyl-3-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}-2,3-dihydro-1,3-thiazol-2-ylidene]benzamide

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

V027-2173

Molecular Formula

C24H23Cl2N3O2S (C24 H23 Cl2 N3 O2 S)

Compound Name

2,4-dichloro-N-[(2Z)-4,5-dimethyl-3-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}-2,3-dihydro-1,3-thiazol-2-ylidene]benzamide

IUPAC name

24-dichloro-N-[(2Z)-45-dimethyl-3-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}-23-dihydro-13-thiazol-2-ylidene]benzamide

SMILES

CC(N1Cc(cc2)ccc2C(N2CCCC2)=O)=C(C)S/C1=N\C(c(ccc(Cl)c1)c1Cl)=O

InChI

InChI=1S/C24H23Cl2N3O2S/c1-15-16(2)32-24(27-22(30)20-10-9-19(25)13-21(20)26)29(15)14-17-5-7-18(8-6-17)23(31)28-11-3-4-12-28/h5-10,13H,3-4,11-12,14H2,1-2H3

InChI Key

LBPFPBLZLHHRKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19791929

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

488.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.943

Distribution Coefficient, logD

4.943

Water Solubility, LogSw

-4.96

Polar Surface Area

42.774

Acid Dissociation Constant (pKa)

27.66

Base Dissociation Constant (pKb)

-0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

V027-2173 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V027-2173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-2173?
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What is the minimum amount of V027-2173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-2173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-2173
  • 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 V027-2173 available by request