BAS 04996142
TL;DR: BAS 04996142 (CAS 797814-77-8) is a chemical compound with molecular formula C19H23N5O3 and molecular weight 369.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(3-ethoxypropyl)-6-imino-N,11-dimethyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: BAS 04996142, 1-(3-ethoxypropyl)-2-imino-N,10-dimethyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C19H23N5O3 |
|---|---|
| Molecular Weight | 369.18 g/mol |
| LogP | 1.22329 |
| Topological Polar Surface Area | 101.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 369.18008 |
| Heavy Atoms | 27 |
| Complexity | 1130.0736 |
Chemical Identifiers
| CAS Number | 797814-77-8 |
|---|---|
| SMILES | CCOCCCN1C2=C(C=C(C1=N)C(=O)NC)C(=O)N3C=CC=C(C3=N2)C |
Product Overview
BAS 04996142 (CAS 797814-77-8), with molecular formula C19H23N5O3 and molecular weight 369.18 g/mol. IUPAC: 7-(3-ethoxypropyl)-6-imino-N,11-dimethyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of BAS 04996142
Property Insights of BAS 04996142
The XLogP value of 1.22329 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04996142. The TPSA of 101.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04996142. Following Lipinski's Rule of Five, BAS 04996142 has 2 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 04996142?
The CAS number of BAS 04996142 is 797814-77-8.
What is the molecular formula of BAS 04996142?
The molecular formula of BAS 04996142 is C19H23N5O3.
What is the molecular weight of BAS 04996142?
The molecular weight of BAS 04996142 is 369.18 g/mol.
Where can I buy BAS 04996142?
You can request a quote for BAS 04996142 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04996142?
Yes, KEHONG BIO provides custom synthesis services for BAS 04996142 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.