F602-1149 Screening compound: methyl 5-(3-{[2-(4-ethylpiperazin-1-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

F602-1149 Screening compound: methyl 5-(3-{[2-(4-ethylpiperazin-1-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
F602-1149 Screening compound: methyl 5-(3-{[2-(4-ethylpiperazin-1-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F602-1149
methyl 5-(3-{[2-(4-ethylpiperazin-1-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

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

F602-1149

Molecular Formula

C23H37N5O4 (C23 H37 N5 O4)

Compound Name

methyl 5-(3-{[2-(4-ethylpiperazin-1-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

IUPAC name

methyl 5-(3-{[2-(4-ethylpiperazin-1-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-24-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCN1CCN(CCNC(C(CCC2)CN2C(c2c(C)c(C(OC)=O)c(C)[nH]2)=O)=O)CC1

InChI

InChI=1S/C23H37N5O4/c1-5-26-11-13-27(14-12-26)10-8-24-21(29)18-7-6-9-28(15-18)22(30)20-16(2)19(17(3)25-20)23(31)32-4/h18,25H,5-15H2,1-4H3,(H,24,29)/t18-/m0/s1

InChI Key

CFQSDHBFPFQZOQ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27178909

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.508

Distribution Coefficient, logD

-0.284

Water Solubility, LogSw

-1.12

Polar Surface Area

80.750

Acid Dissociation Constant (pKa)

5.30

Base Dissociation Constant (pKb)

8.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

69.60

F602-1149 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F602-1149 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F602-1149?
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What is the minimum amount of F602-1149 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F602-1149
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F602-1149
  • 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 F602-1149 available by request