BAS 05914487
TL;DR: BAS 05914487 (CAS 476479-99-9) is a chemical compound with molecular formula C21H24N6O2 and molecular weight 392.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[2-(dimethylamino)ethylamino]-3-methyl-7-(naphthalen-1-ylmethyl)purine-2,6-dione
Also Known As: BAS 05914487, AB01308649-01, 8-((2-(Dimethylamino)ethyl)amino)-3-methyl-7-(naphthalen-1-ylmethyl)-1H-purine-2,6(3H,7H)-dione, 8-{[2-(DIMETHYLAMINO)ETHYL]AMINO}-3-METHYL-7-(1-NAPHTHYLMETHYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE, 8-{[2-(dimethylamino)ethyl]amino}-3-methyl-7-[(naphthalen-1-yl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C21H24N6O2 |
|---|---|
| Molecular Weight | 392.20 g/mol |
| LogP | 1.5983 |
| Topological Polar Surface Area | 87.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.19608 |
| Heavy Atoms | 29 |
| Complexity | 1293.0048 |
Chemical Identifiers
| CAS Number | 476479-99-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCN(C)C)CC3=CC=CC4=CC=CC=C43 |
Product Overview
BAS 05914487 (CAS 476479-99-9), with molecular formula C21H24N6O2 and molecular weight 392.20 g/mol. IUPAC: 8-[2-(dimethylamino)ethylamino]-3-methyl-7-(naphthalen-1-ylmethyl)purine-2,6-dione.
Chemical Property Profile of BAS 05914487
Property Insights of BAS 05914487
The XLogP value of 1.5983 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05914487. The TPSA of 87.95 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05914487. Following Lipinski's Rule of Five, BAS 05914487 has 2 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 05914487?
The CAS number of BAS 05914487 is 476479-99-9.
What is the molecular formula of BAS 05914487?
The molecular formula of BAS 05914487 is C21H24N6O2.
What is the molecular weight of BAS 05914487?
The molecular weight of BAS 05914487 is 392.20 g/mol.
Where can I buy BAS 05914487?
You can request a quote for BAS 05914487 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05914487?
Yes, KEHONG BIO provides custom synthesis services for BAS 05914487 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.