ChemDiv3_003648
TL;DR: ChemDiv3_003648 (CAS 384801-61-0) is a chemical compound with molecular formula C23H29N5O and molecular weight 391.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-3-methyl-1-(2-morpholin-4-ylethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: ChemDiv3_003648, IDI1_021558, 2-butyl-3-methyl-1-((2-morpholinoethyl)amino)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 2-butyl-3-methyl-1-(2-morpholin-4-ylethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile, BRD-K83038330-001-01-4
| Molecular Formula | C23H29N5O |
|---|---|
| Molecular Weight | 391.24 g/mol |
| LogP | 3.7543 |
| Topological Polar Surface Area | 65.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 391.2372 |
| Heavy Atoms | 29 |
| Complexity | 1043.0149 |
Chemical Identifiers
| CAS Number | 384801-61-0 |
|---|---|
| SMILES | CCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCCN4CCOCC4 |
Product Overview
ChemDiv3_003648 (CAS 384801-61-0), with molecular formula C23H29N5O and molecular weight 391.24 g/mol. IUPAC: 2-butyl-3-methyl-1-(2-morpholin-4-ylethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of ChemDiv3_003648
Property Insights of ChemDiv3_003648
The XLogP value of 3.7543 indicates that ChemDiv3_003648 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.59 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_003648. Following Lipinski's Rule of Five, ChemDiv3_003648 has 1 hydrogen bond donor(s) and 5 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 ChemDiv3_003648?
The CAS number of ChemDiv3_003648 is 384801-61-0.
What is the molecular formula of ChemDiv3_003648?
The molecular formula of ChemDiv3_003648 is C23H29N5O.
What is the molecular weight of ChemDiv3_003648?
The molecular weight of ChemDiv3_003648 is 391.24 g/mol.
Where can I buy ChemDiv3_003648?
You can request a quote for ChemDiv3_003648 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003648?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003648 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.