BAS 15375038
TL;DR: BAS 15375038 (CAS 879071-91-7) is a chemical compound with molecular formula C19H24ClN5O4 and molecular weight 421.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(butan-2-ylamino)-7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methylpurine-2,6-dione
Also Known As: BAS 15375038, AB00689284-01, 8-(sec-butylamino)-7-(3-(4-chlorophenoxy)-2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, F3176-0194, 8-(butan-2-ylamino)-7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methylpurine-2,6-dione
| Molecular Formula | C19H24ClN5O4 |
|---|---|
| Molecular Weight | 421.15 g/mol |
| LogP | 1.727 |
| Topological Polar Surface Area | 114.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 421.15167 |
| Heavy Atoms | 29 |
| Complexity | 1102.7155 |
Chemical Identifiers
| CAS Number | 879071-91-7 |
|---|---|
| SMILES | CCC(C)NC1=NC2=C(N1CC(COC3=CC=C(C=C3)Cl)O)C(=O)NC(=O)N2C |
Product Overview
BAS 15375038 (CAS 879071-91-7), with molecular formula C19H24ClN5O4 and molecular weight 421.15 g/mol. IUPAC: 8-(butan-2-ylamino)-7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methylpurine-2,6-dione.
Chemical Property Profile of BAS 15375038
Property Insights of BAS 15375038
The XLogP value of 1.727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 15375038. The TPSA of 114.17 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 15375038. Following Lipinski's Rule of Five, BAS 15375038 has 3 hydrogen bond donor(s) and 6 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 15375038?
The CAS number of BAS 15375038 is 879071-91-7.
What is the molecular formula of BAS 15375038?
The molecular formula of BAS 15375038 is C19H24ClN5O4.
What is the molecular weight of BAS 15375038?
The molecular weight of BAS 15375038 is 421.15 g/mol.
Where can I buy BAS 15375038?
You can request a quote for BAS 15375038 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 15375038?
Yes, KEHONG BIO provides custom synthesis services for BAS 15375038 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.