AB00109952-01
TL;DR: AB00109952-01 (CAS 473801-57-9) is a chemical compound with molecular formula C19H17N5O2S and molecular weight 379.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylamino)-N-(4-methylphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-4-carboxamide
Also Known As: AB00109952-01, AO-567/40646807, 2-(1,3-benzothiazol-2-ylamino)-N-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyrimidine-4-carboxamide, 2-(1,3-benzothiazol-2-ylamino)-N-(4-methylphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-4-carboxamide, 2-(benzo[d]thiazol-2-ylamino)-6-oxo-N-(p-tolyl)-1,4,5,6-tetrahydropyrimidine-4-carboxamide
| Molecular Formula | C19H17N5O2S |
|---|---|
| Molecular Weight | 379.11 g/mol |
| LogP | 2.89982 |
| Topological Polar Surface Area | 95.48 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.1103 |
| Heavy Atoms | 27 |
| Complexity | 1008.69446 |
Chemical Identifiers
| CAS Number | 473801-57-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)C2CC(=O)NC(=N2)NC3=NC4=CC=CC=C4S3 |
Product Overview
AB00109952-01 (CAS 473801-57-9), with molecular formula C19H17N5O2S and molecular weight 379.11 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylamino)-N-(4-methylphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-4-carboxamide.
Chemical Property Profile of AB00109952-01
Property Insights of AB00109952-01
The XLogP value of 2.89982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00109952-01. The TPSA of 95.48 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00109952-01. Following Lipinski's Rule of Five, AB00109952-01 has 3 hydrogen bond donor(s) and 6 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 AB00109952-01?
The CAS number of AB00109952-01 is 473801-57-9.
What is the molecular formula of AB00109952-01?
The molecular formula of AB00109952-01 is C19H17N5O2S.
What is the molecular weight of AB00109952-01?
The molecular weight of AB00109952-01 is 379.11 g/mol.
Where can I buy AB00109952-01?
You can request a quote for AB00109952-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00109952-01?
Yes, KEHONG BIO provides custom synthesis services for AB00109952-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.