BAS 07401752
TL;DR: BAS 07401752 (CAS 674308-15-7) is a chemical compound with molecular formula C22H23N7O2S and molecular weight 449.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-dimethyl-7-(2-pyrimidin-2-ylsulfanylethyl)purine-2,6-dione
Also Known As: BAS 07401752, UPCMLD0ENAT5829934:001, 1,3-dimethyl-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-8-(1,2,3,4-tetrahydroisoquinolin-2-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 8-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-dimethyl-7-(2-pyrimidin-2-ylsulfanylethyl)purine-2,6-dione, 1,3-dimethyl-7-(2-pyrimidin-2-ylthioethyl)-8-(2-1,2,3,4-tetrahydroisoquinolyl) -1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C22H23N7O2S |
|---|---|
| Molecular Weight | 449.16 g/mol |
| LogP | 1.5787 |
| Topological Polar Surface Area | 90.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 449.1634 |
| Heavy Atoms | 32 |
| Complexity | 1407.8097 |
Chemical Identifiers
| CAS Number | 674308-15-7 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCC4=CC=CC=C4C3)CCSC5=NC=CC=N5 |
Product Overview
BAS 07401752 (CAS 674308-15-7), with molecular formula C22H23N7O2S and molecular weight 449.16 g/mol. IUPAC: 8-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-dimethyl-7-(2-pyrimidin-2-ylsulfanylethyl)purine-2,6-dione.
Chemical Property Profile of BAS 07401752
Property Insights of BAS 07401752
The XLogP value of 1.5787 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07401752. The TPSA of 90.84 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07401752. Following Lipinski's Rule of Five, BAS 07401752 has 0 hydrogen bond donor(s) and 7 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 07401752?
The CAS number of BAS 07401752 is 674308-15-7.
What is the molecular formula of BAS 07401752?
The molecular formula of BAS 07401752 is C22H23N7O2S.
What is the molecular weight of BAS 07401752?
The molecular weight of BAS 07401752 is 449.16 g/mol.
Where can I buy BAS 07401752?
You can request a quote for BAS 07401752 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07401752?
Yes, KEHONG BIO provides custom synthesis services for BAS 07401752 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.