BAS 13030703
TL;DR: BAS 13030703 (CAS 878736-07-3) is a chemical compound with molecular formula C21H23N5O3 and molecular weight 393.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3,3-dimethyl-2-oxobutyl)-2,4-dimethyl-7-phenylpurino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 13030703, UPCMLD0ENAT5820197:001, VU0509690-1, F3124-1125, 6-(3,3-dimethyl-2-oxobutyl)-2,4-dimethyl-7-phenylpurino[7,8-a]imidazole-1,3-dione
| Molecular Formula | C21H23N5O3 |
|---|---|
| Molecular Weight | 393.18 g/mol |
| LogP | 1.9686 |
| Topological Polar Surface Area | 83.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.18008 |
| Heavy Atoms | 29 |
| Complexity | 1377.9524 |
Chemical Identifiers
| CAS Number | 878736-07-3 |
|---|---|
| SMILES | CC(C)(C)C(=O)CN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=CC=C4 |
Product Overview
BAS 13030703 (CAS 878736-07-3), with molecular formula C21H23N5O3 and molecular weight 393.18 g/mol. IUPAC: 6-(3,3-dimethyl-2-oxobutyl)-2,4-dimethyl-7-phenylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 13030703
Property Insights of BAS 13030703
The XLogP value of 1.9686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 13030703. The TPSA of 83.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13030703. Following Lipinski's Rule of Five, BAS 13030703 has 0 hydrogen bond donor(s) and 4 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 13030703?
The CAS number of BAS 13030703 is 878736-07-3.
What is the molecular formula of BAS 13030703?
The molecular formula of BAS 13030703 is C21H23N5O3.
What is the molecular weight of BAS 13030703?
The molecular weight of BAS 13030703 is 393.18 g/mol.
Where can I buy BAS 13030703?
You can request a quote for BAS 13030703 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13030703?
Yes, KEHONG BIO provides custom synthesis services for BAS 13030703 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.