AB00113583-01
TL;DR: AB00113583-01 (CAS 430468-28-3) is a chemical compound with molecular formula C18H15F2N3O2S and molecular weight 375.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-difluorophenyl)-4-(4-hydroxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: AB00113583-01, N-(3,4-difluorophenyl)-4-(4-hydroxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide, N-(3,4-difluorophenyl)-4-(4-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, N-(3,4-difluorophenyl)-6-(4-hydroxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxamide
| Molecular Formula | C18H15F2N3O2S |
|---|---|
| Molecular Weight | 375.09 g/mol |
| LogP | 3.1019 |
| Topological Polar Surface Area | 73.39 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.0853 |
| Heavy Atoms | 26 |
| Complexity | 913.1523 |
Chemical Identifiers
| CAS Number | 430468-28-3 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)O)C(=O)NC3=CC(=C(C=C3)F)F |
Product Overview
AB00113583-01 (CAS 430468-28-3), with molecular formula C18H15F2N3O2S and molecular weight 375.09 g/mol. IUPAC: N-(3,4-difluorophenyl)-4-(4-hydroxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of AB00113583-01
Property Insights of AB00113583-01
The XLogP value of 3.1019 indicates that AB00113583-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.39 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00113583-01. Following Lipinski's Rule of Five, AB00113583-01 has 4 hydrogen bond donor(s) and 3 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 AB00113583-01?
The CAS number of AB00113583-01 is 430468-28-3.
What is the molecular formula of AB00113583-01?
The molecular formula of AB00113583-01 is C18H15F2N3O2S.
What is the molecular weight of AB00113583-01?
The molecular weight of AB00113583-01 is 375.09 g/mol.
Where can I buy AB00113583-01?
You can request a quote for AB00113583-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00113583-01?
Yes, KEHONG BIO provides custom synthesis services for AB00113583-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.