BAS 00867299
TL;DR: BAS 00867299 (CAS 355142-90-4) is a chemical compound with molecular formula C20H18N2O6 and molecular weight 382.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[3-(1,3-benzodioxol-5-ylmethylamino)-2,5-dioxopyrrolidin-1-yl]benzoate
Also Known As: BAS 00867299, AB00095567-01, A1846/0077657, methyl 4-(3-((benzo[d][1,3]dioxol-5-ylmethyl)amino)-2,5-dioxopyrrolidin-1-yl)benzoate, methyl 4-[3-(1,3-benzodioxol-5-ylmethylamino)-2,5-dioxopyrrolidin-1-yl]benzoate
| Molecular Formula | C20H18N2O6 |
|---|---|
| Molecular Weight | 382.12 g/mol |
| LogP | 1.6236 |
| Topological Polar Surface Area | 94.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.1165 |
| Heavy Atoms | 28 |
| Complexity | 940.21216 |
Chemical Identifiers
| CAS Number | 355142-90-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)NCC3=CC4=C(C=C3)OCO4 |
Product Overview
BAS 00867299 (CAS 355142-90-4), with molecular formula C20H18N2O6 and molecular weight 382.12 g/mol. IUPAC: methyl 4-[3-(1,3-benzodioxol-5-ylmethylamino)-2,5-dioxopyrrolidin-1-yl]benzoate.
Chemical Property Profile of BAS 00867299
Property Insights of BAS 00867299
The XLogP value of 1.6236 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00867299. The TPSA of 94.17 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00867299. Following Lipinski's Rule of Five, BAS 00867299 has 1 hydrogen bond donor(s) and 7 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 00867299?
The CAS number of BAS 00867299 is 355142-90-4.
What is the molecular formula of BAS 00867299?
The molecular formula of BAS 00867299 is C20H18N2O6.
What is the molecular weight of BAS 00867299?
The molecular weight of BAS 00867299 is 382.12 g/mol.
Where can I buy BAS 00867299?
You can request a quote for BAS 00867299 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00867299?
Yes, KEHONG BIO provides custom synthesis services for BAS 00867299 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.