AO-081/14338022
TL;DR: AO-081/14338022 (CAS 6629-28-3) is a chemical compound with molecular formula C18H19N3O2 and molecular weight 309.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[1-(2,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]imidazolidine-2,4-dione
Also Known As: AO-081/14338022, (5Z)-5-[[1-(2,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]imidazolidine-2,4-dione, 5-{[1-(2,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4-imidazolidinedione, (Z)-5-((1-(2,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)imidazolidine-2,4-dione, (5Z)-5-{[1-(2,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-4-hydroxy-1,5-dihydro-2H-imidazol-2-one
| Molecular Formula | C18H19N3O2 |
|---|---|
| Molecular Weight | 309.15 g/mol |
| LogP | 2.89128 |
| Topological Polar Surface Area | 63.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.14774 |
| Heavy Atoms | 23 |
| Complexity | 859.3919 |
Chemical Identifiers
| CAS Number | 6629-28-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C(=CC(=C2C)/C=C\3/C(=O)NC(=O)N3)C)C |
Product Overview
AO-081/14338022 (CAS 6629-28-3), with molecular formula C18H19N3O2 and molecular weight 309.15 g/mol. IUPAC: (5Z)-5-[[1-(2,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]imidazolidine-2,4-dione.
Chemical Property Profile of AO-081/14338022
Property Insights of AO-081/14338022
The XLogP value of 2.89128 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-081/14338022. The TPSA of 63.13 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/14338022. Following Lipinski's Rule of Five, AO-081/14338022 has 2 hydrogen bond donor(s) and 2 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 AO-081/14338022?
The CAS number of AO-081/14338022 is 6629-28-3.
What is the molecular formula of AO-081/14338022?
The molecular formula of AO-081/14338022 is C18H19N3O2.
What is the molecular weight of AO-081/14338022?
The molecular weight of AO-081/14338022 is 309.15 g/mol.
Where can I buy AO-081/14338022?
You can request a quote for AO-081/14338022 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/14338022?
Yes, KEHONG BIO provides custom synthesis services for AO-081/14338022 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.