BAS 04901300
TL;DR: BAS 04901300 (CAS 440109-36-4) is a chemical compound with molecular formula C21H21F3N2O2 and molecular weight 390.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxo-1-(4-propan-2-ylphenyl)-N-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
Also Known As: BAS 04901300, 5-oxo-1-(4-propan-2-ylphenyl)-N-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide, {1-[4-(methylethyl)phenyl]-5-oxopyrrolidin-3-yl}-N-[2-(trifluoromethyl)phenyl] carboxamide, 5-oxo-1-[4-(propan-2-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
| Molecular Formula | C21H21F3N2O2 |
|---|---|
| Molecular Weight | 390.16 g/mol |
| LogP | 4.8204 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.15552 |
| Heavy Atoms | 28 |
| Complexity | 875.9646 |
Chemical Identifiers
| CAS Number | 440109-36-4 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=CC=C3C(F)(F)F |
Product Overview
BAS 04901300 (CAS 440109-36-4), with molecular formula C21H21F3N2O2 and molecular weight 390.16 g/mol. IUPAC: 5-oxo-1-(4-propan-2-ylphenyl)-N-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide.
Chemical Property Profile of BAS 04901300
Property Insights of BAS 04901300
The XLogP value of 4.8204 indicates that BAS 04901300 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, BAS 04901300 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04901300 has 1 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 BAS 04901300?
The CAS number of BAS 04901300 is 440109-36-4.
What is the molecular formula of BAS 04901300?
The molecular formula of BAS 04901300 is C21H21F3N2O2.
What is the molecular weight of BAS 04901300?
The molecular weight of BAS 04901300 is 390.16 g/mol.
Where can I buy BAS 04901300?
You can request a quote for BAS 04901300 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04901300?
Yes, KEHONG BIO provides custom synthesis services for BAS 04901300 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.