BAS 00867495
TL;DR: BAS 00867495 (CAS 499100-35-5) is a chemical compound with molecular formula C20H17ClN2O5 and molecular weight 400.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-N-[1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]acetamide
Also Known As: BAS 00867495, N-(1,3-benzodioxol-5-ylmethyl)-N-[1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]acetamide, N-(benzo[d][1,3]dioxol-5-ylmethyl)-N-(1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl)acetamide
| Molecular Formula | C20H17ClN2O5 |
|---|---|
| Molecular Weight | 400.08 g/mol |
| LogP | 2.7493 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.0826 |
| Heavy Atoms | 28 |
| Complexity | 959.5684 |
Chemical Identifiers
| CAS Number | 499100-35-5 |
|---|---|
| SMILES | CC(=O)N(CC1=CC2=C(C=C1)OCO2)C3CC(=O)N(C3=O)C4=CC=C(C=C4)Cl |
Product Overview
BAS 00867495 (CAS 499100-35-5), with molecular formula C20H17ClN2O5 and molecular weight 400.08 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-N-[1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]acetamide.
Chemical Property Profile of BAS 00867495
Property Insights of BAS 00867495
The XLogP value of 2.7493 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00867495. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00867495. Following Lipinski's Rule of Five, BAS 00867495 has 0 hydrogen bond donor(s) and 5 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 00867495?
The CAS number of BAS 00867495 is 499100-35-5.
What is the molecular formula of BAS 00867495?
The molecular formula of BAS 00867495 is C20H17ClN2O5.
What is the molecular weight of BAS 00867495?
The molecular weight of BAS 00867495 is 400.08 g/mol.
Where can I buy BAS 00867495?
You can request a quote for BAS 00867495 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00867495?
Yes, KEHONG BIO provides custom synthesis services for BAS 00867495 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.