BAS 07401434
TL;DR: BAS 07401434 (CAS 577960-29-3) is a chemical compound with molecular formula C22H30N6O2 and molecular weight 410.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-7-(3-phenylpropyl)purine-2,6-dione
Also Known As: BAS 07401434, 1,3-Dimethyl-8-(4-methyl-piperazin-1-ylmethyl)-7-(3-phenyl-propyl)-3,7-dihydro-purine-2,6-dione, 1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-7-(3-phenylpropyl)purine-2,6-dione, 1,3-dimethyl-8-((4-methylpiperazin-1-yl)methyl)-7-(3-phenylpropyl)-1H-purine-2,6(3H,7H)-dione, 1,3-dimethyl-8-((4-methylpiperazin-1-yl)methyl)-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C22H30N6O2 |
|---|---|
| Molecular Weight | 410.24 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.243 |
| Heavy Atoms | 30 |
| Complexity | 617.0 |
Chemical Identifiers
| CAS Number | 577960-29-3 |
|---|---|
| SMILES | CN1CCN(CC1)CC2=NC3=C(N2CCCC4=CC=CC=C4)C(=O)N(C(=O)N3C)C |
| InChIKey | VTKABFDTNQRXDU-UHFFFAOYSA-N |
Product Overview
BAS 07401434 (CAS 577960-29-3), with molecular formula C22H30N6O2 and molecular weight 410.24 g/mol. IUPAC: 1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-7-(3-phenylpropyl)purine-2,6-dione.
Chemical Property Profile of BAS 07401434
Property Insights of BAS 07401434
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07401434. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07401434. Following Lipinski's Rule of Five, BAS 07401434 has 0 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 07401434?
The CAS number of BAS 07401434 is 577960-29-3.
What is the molecular formula of BAS 07401434?
The molecular formula of BAS 07401434 is C22H30N6O2.
What is the molecular weight of BAS 07401434?
The molecular weight of BAS 07401434 is 410.24 g/mol.
Where can I buy BAS 07401434?
You can request a quote for BAS 07401434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07401434?
Yes, KEHONG BIO provides custom synthesis services for BAS 07401434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.