M480-0602 Screening compound: 1-(3-chloro-4-methylphenyl)-3-(2-{5-[(propan-2-yl)sulfamoyl]-1H-1,3-benzodiazol-1-yl}ethyl)urea

M480-0602 Screening compound: 1-(3-chloro-4-methylphenyl)-3-(2-{5-[(propan-2-yl)sulfamoyl]-1H-1,3-benzodiazol-1-yl}ethyl)urea
M480-0602 Screening compound: 1-(3-chloro-4-methylphenyl)-3-(2-{5-[(propan-2-yl)sulfamoyl]-1H-1,3-benzodiazol-1-yl}ethyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound M480-0602
1-(3-chloro-4-methylphenyl)-3-(2-{5-[(propan-2-yl)sulfamoyl]-1H-1,3-benzodiazol-1-yl}ethyl)urea

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

M480-0602

Molecular Formula

C20H24ClN5O3S (C20 H24 ClN5 O3 S)

Compound Name

1-(3-chloro-4-methylphenyl)-3-(2-{5-[(propan-2-yl)sulfamoyl]-1H-1,3-benzodiazol-1-yl}ethyl)urea

IUPAC name

1-(3-chloro-4-methylphenyl)-3-(2-{5-[(propan-2-yl)sulfamoyl]-1H-13-benzodiazol-1-yl}ethyl)urea

SMILES

CC(C)NS(c(cc1)cc2c1n(CCNC(Nc1cc(Cl)c(C)cc1)=O)cn2)(=O)=O

InChI

InChI=1S/C20H24ClN5O3S/c1-13(2)25-30(28,29)16-6-7-19-18(11-16)23-12-26(19)9-8-22-20(27)24-15-5-4-14(3)17(21)10-15/h4-7,10-13,25H,8-9H2,1-3H3,(H2,22,24,27)

InChI Key

ZEYBCQDDSYXHGI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27544383

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.96

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.822

Distribution Coefficient, logD

3.815

Water Solubility, LogSw

-4.16

Polar Surface Area

85.357

Acid Dissociation Constant (pKa)

10.67

Base Dissociation Constant (pKb)

5.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

M480-0602 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with M480-0602 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M480-0602?
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What is the minimum amount of M480-0602 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M480-0602
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M480-0602
  • 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 M480-0602 available by request