K221-3228 Screening compound: 4-[(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-(3-ethoxypropyl)cyclohexane-1-carboxamide

K221-3228 Screening compound: 4-[(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-(3-ethoxypropyl)cyclohexane-1-carboxamide
K221-3228 Screening compound: 4-[(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-(3-ethoxypropyl)cyclohexane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K221-3228
4-[(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-(3-ethoxypropyl)cyclohexane-1-carboxamide

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

K221-3228

Molecular Formula

C21H29N3O4 (C21 H29 N3 O4)

Compound Name

4-[(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-(3-ethoxypropyl)cyclohexane-1-carboxamide

IUPAC name

4-[(24-dioxo-1234-tetrahydroquinazolin-3-yl)methyl]-N-(3-ethoxypropyl)cyclohexane-1-carboxamide

SMILES

CCOCCCNC(C1CCC(CN(C(c(cccc2)c2N2)=O)C2=O)CC1)=O

InChI

InChI=1S/C21H29N3O4/c1-2-28-13-5-12-22-19(25)16-10-8-15(9-11-16)14-24-20(26)17-6-3-4-7-18(17)23-21(24)27/h3-4,6-7,15-16H,2,5,8-14H2,1H3,(H,22,25)(H,23,27)

InChI Key

MGJANJKQNVUQFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15082235

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.037

Distribution Coefficient, logD

3.036

Water Solubility, LogSw

-3.42

Polar Surface Area

73.176

Acid Dissociation Constant (pKa)

10.12

Base Dissociation Constant (pKb)

0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

References: we are preparing a list of scientific research reports with K221-3228 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K221-3228?
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What is the minimum amount of K221-3228 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K221-3228
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K221-3228
  • 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 K221-3228 available by request