Cambridge id 6787422
TL;DR: Cambridge id 6787422 (CAS 431987-00-7) is a chemical compound with molecular formula C23H24N4O3S and molecular weight 436.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[4-nitro-3-(2-phenylethylamino)phenyl]piperazin-1-yl]-thiophen-2-ylmethanone
Also Known As: AB00119185-01, A2963/0124817, (4-{4-nitro-3-[(2-phenylethyl)amino]phenyl}piperazin-1-yl)(thiophen-2-yl)methanone, [4-[4-nitro-3-(2-phenylethylamino)phenyl]piperazin-1-yl]-thiophen-2-ylmethanone, [4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]-thiophen-2-ylmethanone
| Molecular Formula | C23H24N4O3S |
|---|---|
| Molecular Weight | 436.16 g/mol |
| LogP | 4.2733 |
| Topological Polar Surface Area | 78.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 436.15692 |
| Heavy Atoms | 31 |
| Complexity | 1032.2399 |
Chemical Identifiers
| CAS Number | 431987-00-7 |
|---|---|
| SMILES | C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCCC3=CC=CC=C3)C(=O)C4=CC=CS4 |
Product Overview
Cambridge id 6787422 (CAS 431987-00-7), with molecular formula C23H24N4O3S and molecular weight 436.16 g/mol. IUPAC: [4-[4-nitro-3-(2-phenylethylamino)phenyl]piperazin-1-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of Cambridge id 6787422
Property Insights of Cambridge id 6787422
The XLogP value of 4.2733 indicates that Cambridge id 6787422 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.72 Ų falls within the moderate polarity range, balancing permeability and solubility for Cambridge id 6787422. Following Lipinski's Rule of Five, Cambridge id 6787422 has 1 hydrogen bond donor(s) and 6 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 Cambridge id 6787422?
The CAS number of Cambridge id 6787422 is 431987-00-7.
What is the molecular formula of Cambridge id 6787422?
The molecular formula of Cambridge id 6787422 is C23H24N4O3S.
What is the molecular weight of Cambridge id 6787422?
The molecular weight of Cambridge id 6787422 is 436.16 g/mol.
Where can I buy Cambridge id 6787422?
You can request a quote for Cambridge id 6787422 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 6787422?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 6787422 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.