AB00119013-01
TL;DR: AB00119013-01 (CAS 431983-57-2) is a chemical compound with molecular formula C19H18N2O2S and molecular weight 338.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(3,4-dimethylphenyl)-5-[(4-methoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
Also Known As: AB00119013-01, AN-989/40823240, (5Z)-3-(3,4-dimethylphenyl)-5-[(4-methoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one, 3-(3,4-dimethylphenyl)-5-(4-methoxybenzylidene)-2-thioxo-4-imidazolidinone, (5Z)-3-(3,4-dimethylphenyl)-5-(4-methoxybenzylidene)-2-thioxoimidazolidin-4-one
| Molecular Formula | C19H18N2O2S |
|---|---|
| Molecular Weight | 338.11 g/mol |
| LogP | 3.57424 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.1089 |
| Heavy Atoms | 24 |
| Complexity | 840.9453 |
Chemical Identifiers
| CAS Number | 431983-57-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=O)/C(=C/C3=CC=C(C=C3)OC)/NC2=S)C |
Product Overview
AB00119013-01 (CAS 431983-57-2), with molecular formula C19H18N2O2S and molecular weight 338.11 g/mol. IUPAC: (5Z)-3-(3,4-dimethylphenyl)-5-[(4-methoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of AB00119013-01
Property Insights of AB00119013-01
The XLogP value of 3.57424 indicates that AB00119013-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, AB00119013-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00119013-01 has 1 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 AB00119013-01?
The CAS number of AB00119013-01 is 431983-57-2.
What is the molecular formula of AB00119013-01?
The molecular formula of AB00119013-01 is C19H18N2O2S.
What is the molecular weight of AB00119013-01?
The molecular weight of AB00119013-01 is 338.11 g/mol.
Where can I buy AB00119013-01?
You can request a quote for AB00119013-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00119013-01?
Yes, KEHONG BIO provides custom synthesis services for AB00119013-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.