V022-6542 Screening compound: N-(cyclopropylmethyl)-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide

V022-6542 Screening compound: N-(cyclopropylmethyl)-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
V022-6542 Screening compound: N-(cyclopropylmethyl)-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-6542
N-(cyclopropylmethyl)-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)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

V022-6542

Molecular Formula

C30H35N5O4 (C30 H35 N5 O4)

Compound Name

N-(cyclopropylmethyl)-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide

IUPAC name

N-(cyclopropylmethyl)-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-14-diazepan-1-yl}-2-oxoethyl)benzamide

SMILES

COc1cccc(C(N(CC2CC2)CC(N(CCC2)CCN2c(cc2)nnc2-c2cc(OC)ccc2)=O)=O)c1

InChI

InChI=1S/C30H35N5O4/c1-38-25-8-3-6-23(18-25)27-12-13-28(32-31-27)33-14-5-15-34(17-16-33)29(36)21-35(20-22-10-11-22)30(37)24-7-4-9-26(19-24)39-2/h3-4,6-9,12-13,18-19,22H,5,10-11,14-17,20-21H2,1-2H3

InChI Key

ZAJLRTAYUXUDPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19833462

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

529.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.788

Distribution Coefficient, logD

3.618

Water Solubility, LogSw

-3.96

Polar Surface Area

72.707

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

7.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with V022-6542 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-6542?
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What is the minimum amount of V022-6542 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-6542
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-6542
  • 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 V022-6542 available by request