1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺
TL;DR: 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺 (CAS 85532-75-8) is a chemical compound with molecular formula C21H21ClN2O and molecular weight 352.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺
N-butan-2-yl-1-(2-chlorophenyl)-N-methylisoquinoline-3-carboxamide
Also Known As: 1-(2-Chlorophenyl)-N-methyl-N-(1-methylpropyl)-3-isoquinolinecarboxamide, Biomol-NT_000287, Lopac0_000198, Interferon alfa (IFN-alpha), BPBio1_001278
| Molecular Formula | C21H21ClN2O |
|---|---|
| Molecular Weight | 352.13 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 33.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.13425 |
| Heavy Atoms | 25 |
| Complexity | 457.0 |
Chemical Identifiers
| CAS Number | 85532-75-8 |
|---|---|
| SMILES | CCC(C)N(C)C(=O)C1=CC2=CC=CC=C2C(=N1)C3=CC=CC=C3Cl |
| InChIKey | RAVIZVQZGXBOQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺 (CAS 85532-75-8), with molecular formula C21H21ClN2O and molecular weight 352.13 g/mol. IUPAC: N-butan-2-yl-1-(2-chlorophenyl)-N-methylisoquinoline-3-carboxamide.
Chemical Property Profile of 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺
Property Insights of 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺
The XLogP value of 5.5 indicates that 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.2 Ų, 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺?
The CAS number of 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺 is 85532-75-8.
What is the molecular formula of 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺?
The molecular formula of 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺 is C21H21ClN2O.
What is the molecular weight of 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺?
The molecular weight of 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺 is 352.13 g/mol.
Where can I buy 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺?
You can request a quote for 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-氯苯基)-N-甲基-N-(1-甲基丙基)-3-异喹啉甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.