AB00111929-01
TL;DR: AB00111929-01 (CAS 429650-28-2) is a chemical compound with molecular formula C17H16N2O3S and molecular weight 328.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(2,7-dimethoxynaphthalen-1-yl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one
Also Known As: AB00111929-01, F0919-1270, (5Z)-5-[(2,7-dimethoxynaphthalen-1-yl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one, (5Z)-5-[(2,7-dimethoxynaphthalen-1-yl)methylidene]-3-methyl-2-thioxoimidazolidin-4-one, (Z)-5-((2,7-dimethoxynaphthalen-1-yl)methylene)-3-methyl-2-thioxoimidazolidin-4-one
| Molecular Formula | C17H16N2O3S |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 2.5444 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.08817 |
| Heavy Atoms | 23 |
| Complexity | 839.8425 |
Chemical Identifiers
| CAS Number | 429650-28-2 |
|---|---|
| SMILES | CN1C(=O)/C(=C/C2=C(C=CC3=C2C=C(C=C3)OC)OC)/NC1=S |
Product Overview
AB00111929-01 (CAS 429650-28-2), with molecular formula C17H16N2O3S and molecular weight 328.09 g/mol. IUPAC: (5Z)-5-[(2,7-dimethoxynaphthalen-1-yl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of AB00111929-01
Property Insights of AB00111929-01
The XLogP value of 2.5444 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00111929-01. With a topological polar surface area (TPSA) of 50.8 Ų, AB00111929-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00111929-01 has 1 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 AB00111929-01?
The CAS number of AB00111929-01 is 429650-28-2.
What is the molecular formula of AB00111929-01?
The molecular formula of AB00111929-01 is C17H16N2O3S.
What is the molecular weight of AB00111929-01?
The molecular weight of AB00111929-01 is 328.09 g/mol.
Where can I buy AB00111929-01?
You can request a quote for AB00111929-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00111929-01?
Yes, KEHONG BIO provides custom synthesis services for AB00111929-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.