BAS 01122590
TL;DR: BAS 01122590 (CAS 332103-76-1) is a chemical compound with molecular formula C24H23N7O5 and molecular weight 489.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(2-hydroxy-1H-indol-3-yl)diazenyl]-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methylpurine-2,6-dione
Also Known As: BAS 01122590, (Z)-7-(2-hydroxy-3-(o-tolyloxy)propyl)-3-methyl-8-(2-(2-oxoindolin-3-ylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione, 7-[2-HYDROXY-3-(2-METHYLPHENOXY)PROPYL]-3-METHYL-8-[(2E)-2-(2-OXO-1,2-DIHYDRO-3H-INDOL-3-YLIDENE)HYDRAZINO]-3,7-DIHYDRO-1H-PURINE-2,6-DIONE, 7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-[(2Z)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione, 7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-[2-(2-oxoindol-3-yl)hydrazinyl]purine-2,6-dione
| Molecular Formula | C24H23N7O5 |
|---|---|
| Molecular Weight | 489.18 g/mol |
| LogP | 2.77392 |
| Topological Polar Surface Area | 162.88 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 489.17606 |
| Heavy Atoms | 36 |
| Complexity | 1726.8547 |
Chemical Identifiers
| CAS Number | 332103-76-1 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC(CN2C3=C(N=C2N=NC4=C(NC5=CC=CC=C54)O)N(C(=O)NC3=O)C)O |
Product Overview
BAS 01122590 (CAS 332103-76-1), with molecular formula C24H23N7O5 and molecular weight 489.18 g/mol. IUPAC: 8-[(2-hydroxy-1H-indol-3-yl)diazenyl]-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methylpurine-2,6-dione.
Chemical Property Profile of BAS 01122590
Property Insights of BAS 01122590
The XLogP value of 2.77392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01122590. The TPSA of 162.88 Ų indicates high polarity, suggesting BAS 01122590 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 01122590 has 4 hydrogen bond donor(s) and 8 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 01122590?
The CAS number of BAS 01122590 is 332103-76-1.
What is the molecular formula of BAS 01122590?
The molecular formula of BAS 01122590 is C24H23N7O5.
What is the molecular weight of BAS 01122590?
The molecular weight of BAS 01122590 is 489.18 g/mol.
Where can I buy BAS 01122590?
You can request a quote for BAS 01122590 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01122590?
Yes, KEHONG BIO provides custom synthesis services for BAS 01122590 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.