BAS 07401754
TL;DR: BAS 07401754 (CAS 587013-91-0) is a chemical compound with molecular formula C19H24ClN5O3 and molecular weight 405.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2-chlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethylpurine-2,6-dione
Also Known As: BAS 07401754, 7-(2-chlorobenzyl)-8-((3-ethoxypropyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, AB01309018-01, F1614-0084, 7-(2-chlorobenzyl)-8-[(3-ethoxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C19H24ClN5O3 |
|---|---|
| Molecular Weight | 405.16 g/mol |
| LogP | 1.9739 |
| Topological Polar Surface Area | 83.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 405.15677 |
| Heavy Atoms | 28 |
| Complexity | 1099.3678 |
Chemical Identifiers
| CAS Number | 587013-91-0 |
|---|---|
| SMILES | CCOCCCNC1=NC2=C(N1CC3=CC=CC=C3Cl)C(=O)N(C(=O)N2C)C |
Product Overview
BAS 07401754 (CAS 587013-91-0), with molecular formula C19H24ClN5O3 and molecular weight 405.16 g/mol. IUPAC: 7-[(2-chlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of BAS 07401754
Property Insights of BAS 07401754
The XLogP value of 1.9739 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07401754. The TPSA of 83.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07401754. Following Lipinski's Rule of Five, BAS 07401754 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 07401754?
The CAS number of BAS 07401754 is 587013-91-0.
What is the molecular formula of BAS 07401754?
The molecular formula of BAS 07401754 is C19H24ClN5O3.
What is the molecular weight of BAS 07401754?
The molecular weight of BAS 07401754 is 405.16 g/mol.
Where can I buy BAS 07401754?
You can request a quote for BAS 07401754 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07401754?
Yes, KEHONG BIO provides custom synthesis services for BAS 07401754 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.