BAS 05341104
TL;DR: BAS 05341104 (CAS 488801-98-5) is a chemical compound with molecular formula C21H22N2O4 and molecular weight 366.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
Also Known As: BAS 05341104, AO-081/40800157, N-(1,3-benzodioxol-5-ylmethyl)-1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxamide, N-(benzo[d][1,3]dioxol-5-ylmethyl)-1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
| Molecular Formula | C21H22N2O4 |
|---|---|
| Molecular Weight | 366.16 g/mol |
| LogP | 2.70144 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.15796 |
| Heavy Atoms | 27 |
| Complexity | 909.0498 |
Chemical Identifiers
| CAS Number | 488801-98-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NCC3=CC4=C(C=C3)OCO4)C |
Product Overview
BAS 05341104 (CAS 488801-98-5), with molecular formula C21H22N2O4 and molecular weight 366.16 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide.
Chemical Property Profile of BAS 05341104
Property Insights of BAS 05341104
The XLogP value of 2.70144 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05341104. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05341104. Following Lipinski's Rule of Five, BAS 05341104 has 1 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 05341104?
The CAS number of BAS 05341104 is 488801-98-5.
What is the molecular formula of BAS 05341104?
The molecular formula of BAS 05341104 is C21H22N2O4.
What is the molecular weight of BAS 05341104?
The molecular weight of BAS 05341104 is 366.16 g/mol.
Where can I buy BAS 05341104?
You can request a quote for BAS 05341104 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05341104?
Yes, KEHONG BIO provides custom synthesis services for BAS 05341104 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.