C260-2702 Screening compound: 4-[1-({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]-N-[(4-methylphenyl)methyl]butanamide
Chemical Structure Depiction of ChemDiv screening compound C260-2702
4-[1-({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]-N-[(4-methylphenyl)methyl]butanamide
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
C260-2702
Molecular Formula
C32H36N4O6 (C32 H36 N4 O6)
Compound Name
4-[1-({[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}methyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl]-N-[(4-methylphenyl)methyl]butanamide
IUPAC name
4-[1-({[2-(34-dimethoxyphenyl)ethyl]carbamoyl}methyl)-24-dioxo-1234-tetrahydroquinazolin-3-yl]-N-[(4-methylphenyl)methyl]butanamide
SMILES
Cc1ccc(CNC(CCCN(C(c(cccc2)c2N2CC(NCCc(cc3)cc(OC)c3OC)=O)=O)C2=O)=O)cc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
572.66
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
15.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
1.957
Distribution Coefficient, logD
1.957
Water Solubility, LogSw
-2.95
Polar Surface Area
95.291
Acid Dissociation Constant (pKa)
13.01
Base Dissociation Constant (pKb)
-0.14
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
31.30
C260-2702 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
Antibacterial Compounds Library (13827 compounds)
Included in 1.7M Stock Database
- Cancer
- Infections
- Immune system
- animal
References: we are preparing a list of scientific research reports with C260-2702 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)