BAS 00887274
TL;DR: BAS 00887274 (CAS 332058-80-7) is a chemical compound with molecular formula C19H19N3O4 and molecular weight 353.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-[(Z)-(2,5-dioxoimidazolidin-4-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzoate
Also Known As: BAS 00887274, BIM-0002165.P001, AM-879/12211046, ethyl 4-[3-[(Z)-(2,5-dioxoimidazolidin-4-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzoate, ethyl 4-{3-[(2,5-dioxo-4-imidazolidinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
| Molecular Formula | C19H19N3O4 |
|---|---|
| Molecular Weight | 353.14 g/mol |
| LogP | 2.45114 |
| Topological Polar Surface Area | 89.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.13754 |
| Heavy Atoms | 26 |
| Complexity | 923.00604 |
Chemical Identifiers
| CAS Number | 332058-80-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)/C=C\3/C(=O)NC(=O)N3)C |
Product Overview
BAS 00887274 (CAS 332058-80-7), with molecular formula C19H19N3O4 and molecular weight 353.14 g/mol. IUPAC: ethyl 4-[3-[(Z)-(2,5-dioxoimidazolidin-4-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzoate.
Chemical Property Profile of BAS 00887274
Property Insights of BAS 00887274
The XLogP value of 2.45114 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00887274. The TPSA of 89.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00887274. Following Lipinski's Rule of Five, BAS 00887274 has 2 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 BAS 00887274?
The CAS number of BAS 00887274 is 332058-80-7.
What is the molecular formula of BAS 00887274?
The molecular formula of BAS 00887274 is C19H19N3O4.
What is the molecular weight of BAS 00887274?
The molecular weight of BAS 00887274 is 353.14 g/mol.
Where can I buy BAS 00887274?
You can request a quote for BAS 00887274 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00887274?
Yes, KEHONG BIO provides custom synthesis services for BAS 00887274 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.