MixCom6_001697
TL;DR: MixCom6_001697 (CAS 355403-68-8) is a chemical compound with molecular formula C20H17BrN2O5 and molecular weight 444.03 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-bromophenyl)-2,5-dioxopyrrolidin-3-yl]acetamide
Also Known As: MixCom6_001697, BAS 00867493, BIM-0032197.P001, N-(1,3-benzodioxol-5-ylmethyl)-N-[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]acetamide, N-(benzo[d][1,3]dioxol-5-ylmethyl)-N-(1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl)acetamide
| Molecular Formula | C20H17BrN2O5 |
|---|---|
| Molecular Weight | 444.03 g/mol |
| LogP | 2.8584 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.03207 |
| Heavy Atoms | 28 |
| Complexity | 959.5684 |
Chemical Identifiers
| CAS Number | 355403-68-8 |
|---|---|
| SMILES | CC(=O)N(CC1=CC2=C(C=C1)OCO2)C3CC(=O)N(C3=O)C4=CC=C(C=C4)Br |
Product Overview
MixCom6_001697 (CAS 355403-68-8), with molecular formula C20H17BrN2O5 and molecular weight 444.03 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-N-[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]acetamide.
Chemical Property Profile of MixCom6_001697
Property Insights of MixCom6_001697
The XLogP value of 2.8584 suggests moderate lipophilicity, balancing water solubility and membrane permeability for MixCom6_001697. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for MixCom6_001697. Following Lipinski's Rule of Five, MixCom6_001697 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 MixCom6_001697?
The CAS number of MixCom6_001697 is 355403-68-8.
What is the molecular formula of MixCom6_001697?
The molecular formula of MixCom6_001697 is C20H17BrN2O5.
What is the molecular weight of MixCom6_001697?
The molecular weight of MixCom6_001697 is 444.03 g/mol.
Where can I buy MixCom6_001697?
You can request a quote for MixCom6_001697 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_001697?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_001697 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.