AB00117575-01
TL;DR: AB00117575-01 (CAS 317324-07-5) is a chemical compound with molecular formula C17H17N3O2S and molecular weight 327.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxynaphthalen-1-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: AB00117575-01, AN-023/13711047, 4-(4-methoxynaphthalen-1-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide, 4-(4-methoxynaphthalen-1-yl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, 4-(4-methoxy-1-naphthyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
| Molecular Formula | C17H17N3O2S |
|---|---|
| Molecular Weight | 327.10 g/mol |
| LogP | 2.1265 |
| Topological Polar Surface Area | 76.38 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.10416 |
| Heavy Atoms | 23 |
| Complexity | 844.8474 |
Chemical Identifiers
| CAS Number | 317324-07-5 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=C(C3=CC=CC=C23)OC)C(=O)N |
Product Overview
AB00117575-01 (CAS 317324-07-5), with molecular formula C17H17N3O2S and molecular weight 327.10 g/mol. IUPAC: 4-(4-methoxynaphthalen-1-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of AB00117575-01
Property Insights of AB00117575-01
The XLogP value of 2.1265 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00117575-01. The TPSA of 76.38 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00117575-01. Following Lipinski's Rule of Five, AB00117575-01 has 3 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 AB00117575-01?
The CAS number of AB00117575-01 is 317324-07-5.
What is the molecular formula of AB00117575-01?
The molecular formula of AB00117575-01 is C17H17N3O2S.
What is the molecular weight of AB00117575-01?
The molecular weight of AB00117575-01 is 327.10 g/mol.
Where can I buy AB00117575-01?
You can request a quote for AB00117575-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117575-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117575-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.