A3715/0157351
TL;DR: A3715/0157351 (CAS 663182-19-2) is a chemical compound with molecular formula C18H14ClF3N4O5 and molecular weight 458.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl)-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone
Also Known As: A3715/0157351, (2-chlorophenyl)-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone, (2-chlorophenyl){4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}methanone, (2-CHLOROPHENYL){4-[2,6-DINITRO-4-(TRIFLUOROMETHYL)PHENYL]PIPERAZINO}METHANONE
| Molecular Formula | C18H14ClF3N4O5 |
|---|---|
| Molecular Weight | 458.06 g/mol |
| LogP | 4.1376 |
| Topological Polar Surface Area | 109.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 458.0605 |
| Heavy Atoms | 31 |
| Complexity | 1019.72614 |
Chemical Identifiers
| CAS Number | 663182-19-2 |
|---|---|
| SMILES | C1CN(CCN1C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C(=O)C3=CC=CC=C3Cl |
Product Overview
A3715/0157351 (CAS 663182-19-2), with molecular formula C18H14ClF3N4O5 and molecular weight 458.06 g/mol. IUPAC: (2-chlorophenyl)-[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone.
Chemical Property Profile of A3715/0157351
Property Insights of A3715/0157351
The XLogP value of 4.1376 indicates that A3715/0157351 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.83 Ų falls within the moderate polarity range, balancing permeability and solubility for A3715/0157351. Following Lipinski's Rule of Five, A3715/0157351 has 0 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 A3715/0157351?
The CAS number of A3715/0157351 is 663182-19-2.
What is the molecular formula of A3715/0157351?
The molecular formula of A3715/0157351 is C18H14ClF3N4O5.
What is the molecular weight of A3715/0157351?
The molecular weight of A3715/0157351 is 458.06 g/mol.
Where can I buy A3715/0157351?
You can request a quote for A3715/0157351 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3715/0157351?
Yes, KEHONG BIO provides custom synthesis services for A3715/0157351 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.