2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine
TL;DR: 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine (CAS 315230-85-4) is a chemical compound with molecular formula C17H12ClN3O2 and molecular weight 325.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine
Also Known As: 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine, BAS 01810110, BIM-0005858.P001, AB00102363-01, 2-(4-Chloro-3-nitro-phenyl)-2,3-dihydro-1H-perimidine
| Molecular Formula | C17H12ClN3O2 |
|---|---|
| Molecular Weight | 325.06 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 325.0618 |
| Heavy Atoms | 23 |
| Complexity | 438.0 |
Chemical Identifiers
| CAS Number | 315230-85-4 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)NC(NC3=CC=C2)C4=CC(=C(C=C4)Cl)[N+](=O)[O-] |
| InChIKey | QNPAWQQYFSBQPE-UHFFFAOYSA-N |
Product Overview
2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine (CAS 315230-85-4), with molecular formula C17H12ClN3O2 and molecular weight 325.06 g/mol. IUPAC: 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine.
Chemical Property Profile of 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine
Property Insights of 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine
The XLogP value of 5.0 indicates that 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine. Following Lipinski's Rule of Five, 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine has 2 hydrogen bond donor(s) and 4 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 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine?
The CAS number of 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine is 315230-85-4.
What is the molecular formula of 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine?
The molecular formula of 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine is C17H12ClN3O2.
What is the molecular weight of 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine?
The molecular weight of 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine is 325.06 g/mol.
Where can I buy 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine?
You can request a quote for 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-chloro-3-nitrophenyl)-2,3-dihydro-1H-perimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.