BAS 04996141
TL;DR: BAS 04996141 (CAS 797814-76-7) is a chemical compound with molecular formula C18H21N5O3 and molecular weight 355.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(3-ethoxypropyl)-6-imino-N-methyl-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 04996141, AB00686368-01, 1-(3-ethoxypropyl)-2-imino-N-methyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, F1673-3108, 1-(3-ethoxypropyl)-2-imino-N-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C18H21N5O3 |
|---|---|
| Molecular Weight | 355.16 g/mol |
| LogP | 0.91487 |
| Topological Polar Surface Area | 101.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.16443 |
| Heavy Atoms | 26 |
| Complexity | 1083.7998 |
Chemical Identifiers
| CAS Number | 797814-76-7 |
|---|---|
| SMILES | CCOCCCN1C2=C(C=C(C1=N)C(=O)NC)C(=O)N3C=CC=CC3=N2 |
Product Overview
BAS 04996141 (CAS 797814-76-7), with molecular formula C18H21N5O3 and molecular weight 355.16 g/mol. IUPAC: 7-(3-ethoxypropyl)-6-imino-N-methyl-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 04996141
Property Insights of BAS 04996141
The XLogP value of 0.91487 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04996141. The TPSA of 101.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04996141. Following Lipinski's Rule of Five, BAS 04996141 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 04996141?
The CAS number of BAS 04996141 is 797814-76-7.
What is the molecular formula of BAS 04996141?
The molecular formula of BAS 04996141 is C18H21N5O3.
What is the molecular weight of BAS 04996141?
The molecular weight of BAS 04996141 is 355.16 g/mol.
Where can I buy BAS 04996141?
You can request a quote for BAS 04996141 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04996141?
Yes, KEHONG BIO provides custom synthesis services for BAS 04996141 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.