BAS 00881171
TL;DR: BAS 00881171 (CAS 332056-91-4) is a chemical compound with molecular formula C23H23NO4 and molecular weight 377.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (4Z)-4-[(3-methoxyphenyl)methylidene]-2-methyl-5-oxo-1-(2-phenylethyl)pyrrole-3-carboxylate
Also Known As: BAS 00881171, methyl 4-(3-methoxybenzylidene)-2-methyl-5-oxo-1-(2-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate, (Z)-methyl 4-(3-methoxybenzylidene)-2-methyl-5-oxo-1-phenethyl-4,5-dihydro-1H-pyrrole-3-carboxylate, methyl (4Z)-4-(3-methoxybenzylidene)-2-methyl-5-oxo-1-(2-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate, METHYL (4Z)-4-[(3-METHOXYPHENYL)METHYLIDENE]-2-METHYL-5-OXO-1-(2-PHENYLETHYL)-4,5-DIHYDRO-1H-PYRROLE-3-CARBOXYLATE
| Molecular Formula | C23H23NO4 |
|---|---|
| Molecular Weight | 377.16 g/mol |
| LogP | 3.6105 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 377.16272 |
| Heavy Atoms | 28 |
| Complexity | 944.0845 |
Chemical Identifiers
| CAS Number | 332056-91-4 |
|---|---|
| SMILES | CC1=C(/C(=C/C2=CC(=CC=C2)OC)/C(=O)N1CCC3=CC=CC=C3)C(=O)OC |
Product Overview
BAS 00881171 (CAS 332056-91-4), with molecular formula C23H23NO4 and molecular weight 377.16 g/mol. IUPAC: methyl (4Z)-4-[(3-methoxyphenyl)methylidene]-2-methyl-5-oxo-1-(2-phenylethyl)pyrrole-3-carboxylate.
Chemical Property Profile of BAS 00881171
Property Insights of BAS 00881171
The XLogP value of 3.6105 indicates that BAS 00881171 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, BAS 00881171 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00881171 has 0 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 00881171?
The CAS number of BAS 00881171 is 332056-91-4.
What is the molecular formula of BAS 00881171?
The molecular formula of BAS 00881171 is C23H23NO4.
What is the molecular weight of BAS 00881171?
The molecular weight of BAS 00881171 is 377.16 g/mol.
Where can I buy BAS 00881171?
You can request a quote for BAS 00881171 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00881171?
Yes, KEHONG BIO provides custom synthesis services for BAS 00881171 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.