N-(4-氨基-2-甲苯基)-4-氯邻苯二甲酰亚胺
TL;DR: N-(4-氨基-2-甲苯基)-4-氯邻苯二甲酰亚胺 (CAS 58230-69-6) is a chemical compound with molecular formula C15H11ClN2O2 and molecular weight 286.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-氨基-2-甲苯基)-4-氯邻苯二甲酰亚胺
2-(4-amino-2-methylphenyl)-5-chloroisoindole-1,3-dione
Also Known As: N-(4-Amino-2-methylphenyl)-4-chlorophthalimide, N- -4-CHLOROPHTHALIMIDE, N-(4-Amino-o-tolyl)-4-chlorophthalimide, LIVAQMJLPOCEMO-UHFFFAOYSA-, 2-(4-Amino-2-methylphenyl)-5-chloroisoindoline-1,3-dione
| Molecular Formula | C15H11ClN2O2 |
|---|---|
| Molecular Weight | 286.05 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 286.0509 |
| Heavy Atoms | 20 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 58230-69-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N)N2C(=O)C3=C(C2=O)C=C(C=C3)Cl |
| InChIKey | LIVAQMJLPOCEMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(4-氨基-2-甲苯基)-4-氯邻苯二甲酰亚胺 (CAS 58230-69-6), with molecular formula C15H11ClN2O2 and molecular weight 286.05 g/mol. IUPAC: 2-(4-amino-2-methylphenyl)-5-chloroisoindole-1,3-dione.
Chemical Property Profile of N-(4-氨基-2-甲苯基)-4-氯邻苯二甲酰亚胺
Property Insights of N-(4-氨基-2-甲苯基)-4-氯邻苯二甲酰亚胺
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-氨基-2-甲苯基)-4-氯邻苯二甲酰亚胺. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-氨基-2-甲苯基)-4-氯邻苯二甲酰亚胺. Following Lipinski's Rule of Five, N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺 has 1 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 N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺?
The CAS number of N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺 is 58230-69-6.
What is the molecular formula of N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺?
The molecular formula of N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺 is C15H11ClN2O2.
What is the molecular weight of N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺?
The molecular weight of N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺 is 286.05 g/mol.
Where can I buy N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺?
You can request a quote for N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺?
Yes, KEHONG BIO provides custom synthesis services for N-(4-氨基-邻甲苯基)-4-氯邻苯二甲酰亚胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.