BAS 00447890
TL;DR: BAS 00447890 (CAS 6064-54-6) is a chemical compound with molecular formula C18H17ClN2O2 and molecular weight 328.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-N-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
Also Known As: BAS 00447890, BIM-0003911.P001, 1-(4-chlorophenyl)-N-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide, 1-(4-chlorophenyl)-N-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide, [1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]-N-(4-methylphenyl)carboxamide
| Molecular Formula | C18H17ClN2O2 |
|---|---|
| Molecular Weight | 328.10 g/mol |
| LogP | 3.64002 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.09787 |
| Heavy Atoms | 23 |
| Complexity | 725.6917 |
Chemical Identifiers
| CAS Number | 6064-54-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Cl |
Product Overview
BAS 00447890 (CAS 6064-54-6), with molecular formula C18H17ClN2O2 and molecular weight 328.10 g/mol. IUPAC: 1-(4-chlorophenyl)-N-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide.
Chemical Property Profile of BAS 00447890
Property Insights of BAS 00447890
The XLogP value of 3.64002 indicates that BAS 00447890 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 00447890 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00447890 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 00447890?
The CAS number of BAS 00447890 is 6064-54-6.
What is the molecular formula of BAS 00447890?
The molecular formula of BAS 00447890 is C18H17ClN2O2.
What is the molecular weight of BAS 00447890?
The molecular weight of BAS 00447890 is 328.10 g/mol.
Where can I buy BAS 00447890?
You can request a quote for BAS 00447890 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00447890?
Yes, KEHONG BIO provides custom synthesis services for BAS 00447890 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.