BAS 00312736
TL;DR: BAS 00312736 (CAS 305331-49-1) is a chemical compound with molecular formula C19H21N5O and molecular weight 335.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-(2-morpholin-4-ylethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: BAS 00312736, BIM-0037130.P001, 11-methyl-13-{[2-(morpholin-4-yl)ethyl]amino}-1,8-diazatricyclo[7.4.0.0^{2,7}]trideca-2(7),3,5,8,10,12-hexaene-10-carbonitrile, AB00100009-01, AF-399/36011043
| Molecular Formula | C19H21N5O |
|---|---|
| Molecular Weight | 335.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.17462 |
| Heavy Atoms | 25 |
| Complexity | 499.0 |
Chemical Identifiers
| CAS Number | 305331-49-1 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C(=C1)NCCN4CCOCC4)C#N |
| InChIKey | WESCNKPYTMFUIY-UHFFFAOYSA-N |
Product Overview
BAS 00312736 (CAS 305331-49-1), with molecular formula C19H21N5O and molecular weight 335.17 g/mol. IUPAC: 3-methyl-1-(2-morpholin-4-ylethylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of BAS 00312736
Property Insights of BAS 00312736
The XLogP value of 3.3 indicates that BAS 00312736 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00312736. Following Lipinski's Rule of Five, BAS 00312736 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 BAS 00312736?
The CAS number of BAS 00312736 is 305331-49-1.
What is the molecular formula of BAS 00312736?
The molecular formula of BAS 00312736 is C19H21N5O.
What is the molecular weight of BAS 00312736?
The molecular weight of BAS 00312736 is 335.17 g/mol.
Where can I buy BAS 00312736?
You can request a quote for BAS 00312736 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00312736?
Yes, KEHONG BIO provides custom synthesis services for BAS 00312736 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.