N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide
TL;DR: N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide (CAS 63272-60-6) is a chemical compound with molecular formula C19H17ClN6O and molecular weight 380.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-4-(7-methyl-2,4,6,8,13-pentazatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaen-3-yl)butanamide
Also Known As: N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide, N-(4-chlorophenyl)-4-(7-methyl-2,4,6,8,13-pentazatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaen-3-yl)butanamide
| Molecular Formula | C19H17ClN6O |
|---|---|
| Molecular Weight | 380.12 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.11523 |
| Heavy Atoms | 27 |
| Complexity | 814.0 |
Chemical Identifiers
| CAS Number | 63272-60-6 |
|---|---|
| SMILES | CC1=NC2=NC(=NC3=CC=CC(=N1)N32)CCCC(=O)NC4=CC=C(C=C4)Cl |
| InChIKey | SMYVMQWSDPQHRN-UHFFFAOYSA-N |
Product Overview
N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide (CAS 63272-60-6), with molecular formula C19H17ClN6O and molecular weight 380.12 g/mol. IUPAC: N-(4-chlorophenyl)-4-(7-methyl-2,4,6,8,13-pentazatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaen-3-yl)butanamide.
Chemical Property Profile of N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide
Property Insights of N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide
The XLogP value of 3.7 indicates that N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide. Following Lipinski's Rule of Five, N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide has 1 hydrogen bond donor(s) and 2 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-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide?
The CAS number of N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide is 63272-60-6.
What is the molecular formula of N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide?
The molecular formula of N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide is C19H17ClN6O.
What is the molecular weight of N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide?
The molecular weight of N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide is 380.12 g/mol.
Where can I buy N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide?
You can request a quote for N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Chlorophenyl)-4-(5-methyl-1,3,4,6,9b-pentaazaphenalen-2-yl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.