AB01299074-01
TL;DR: AB01299074-01 (CAS 895841-74-4) is a chemical compound with molecular formula C20H19ClN4O2 and molecular weight 382.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-1-[(2-chlorophenyl)methyl]-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: AB01299074-01, 6-benzyl-1-(2-chlorobenzyl)-2-hydroxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one, 6-benzyl-1-(2-chlorobenzyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 6-benzyl-1-[(2-chlorophenyl)methyl]-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione, 9-benzyl-5-[(2-chlorophenyl)methyl]-3,5,7,9-tetrazabicyclo[4.4.0]dec-11-ene-2,4-dione
| Molecular Formula | C20H19ClN4O2 |
|---|---|
| Molecular Weight | 382.12 g/mol |
| LogP | 2.6235 |
| Topological Polar Surface Area | 70.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.11966 |
| Heavy Atoms | 27 |
| Complexity | 1075.3301 |
Chemical Identifiers
| CAS Number | 895841-74-4 |
|---|---|
| SMILES | C1C2=C(NCN1CC3=CC=CC=C3)N(C(=O)NC2=O)CC4=CC=CC=C4Cl |
Product Overview
AB01299074-01 (CAS 895841-74-4), with molecular formula C20H19ClN4O2 and molecular weight 382.12 g/mol. IUPAC: 6-benzyl-1-[(2-chlorophenyl)methyl]-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of AB01299074-01
Property Insights of AB01299074-01
The XLogP value of 2.6235 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01299074-01. The TPSA of 70.13 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01299074-01. Following Lipinski's Rule of Five, AB01299074-01 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB01299074-01?
The CAS number of AB01299074-01 is 895841-74-4.
What is the molecular formula of AB01299074-01?
The molecular formula of AB01299074-01 is C20H19ClN4O2.
What is the molecular weight of AB01299074-01?
The molecular weight of AB01299074-01 is 382.12 g/mol.
Where can I buy AB01299074-01?
You can request a quote for AB01299074-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01299074-01?
Yes, KEHONG BIO provides custom synthesis services for AB01299074-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.