F3095-4033
TL;DR: F3095-4033 (CAS 6141-10-2) is a chemical compound with molecular formula C16H16BrClN2O2 and molecular weight 382.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(azepan-1-yl)-1-(4-bromophenyl)-4-chloropyrrole-2,5-dione
Also Known As: 3-(1-azepanyl)-1-(4-bromophenyl)-4-chloro-1H-pyrrole-2,5-dione, 3-(azepan-1-yl)-1-(4-bromophenyl)-4-chloro-1H-pyrrole-2,5-dione, 3-(AZEPAN-1-YL)-1-(4-BROMOPHENYL)-4-CHLOROPYRROLE-2,5-DIONE, RefChem:345389
| Molecular Formula | C16H16BrClN2O2 |
|---|---|
| Molecular Weight | 382.01 g/mol |
| LogP | 3.6487 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.00836 |
| Heavy Atoms | 22 |
| Complexity | 634.05084 |
Chemical Identifiers
| CAS Number | 6141-10-2 |
|---|---|
| SMILES | C1CCCN(CC1)C2=C(C(=O)N(C2=O)C3=CC=C(C=C3)Br)Cl |
Product Overview
F3095-4033 (CAS 6141-10-2), with molecular formula C16H16BrClN2O2 and molecular weight 382.01 g/mol. IUPAC: 3-(azepan-1-yl)-1-(4-bromophenyl)-4-chloropyrrole-2,5-dione.
Chemical Property Profile of F3095-4033
Property Insights of F3095-4033
The XLogP value of 3.6487 indicates that F3095-4033 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.62 Ų, F3095-4033 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F3095-4033 has 0 hydrogen bond donor(s) and 3 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 F3095-4033?
The CAS number of F3095-4033 is 6141-10-2.
What is the molecular formula of F3095-4033?
The molecular formula of F3095-4033 is C16H16BrClN2O2.
What is the molecular weight of F3095-4033?
The molecular weight of F3095-4033 is 382.01 g/mol.
Where can I buy F3095-4033?
You can request a quote for F3095-4033 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3095-4033?
Yes, KEHONG BIO provides custom synthesis services for F3095-4033 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.