BAS 01176902
TL;DR: BAS 01176902 (CAS 316357-89-8) is a chemical compound with molecular formula C25H24N2OS2 and molecular weight 432.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,4-dimethylphenyl)methylsulfanyl]-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: BAS 01176902, 2-[(2,4-dimethylbenzyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, AJ-292/12929032, 2-[(2,4-dimethylphenyl)methylsulfanyl]-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 2-((2,4-dimethylbenzyl)thio)-3-phenyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C25H24N2OS2 |
|---|---|
| Molecular Weight | 432.13 g/mol |
| LogP | 6.23514 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 432.133 |
| Heavy Atoms | 30 |
| Complexity | 1288.2404 |
Chemical Identifiers
| CAS Number | 316357-89-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5)C |
Product Overview
BAS 01176902 (CAS 316357-89-8), with molecular formula C25H24N2OS2 and molecular weight 432.13 g/mol. IUPAC: 2-[(2,4-dimethylphenyl)methylsulfanyl]-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of BAS 01176902
Property Insights of BAS 01176902
The XLogP value of 6.23514 indicates that BAS 01176902 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, BAS 01176902 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01176902 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01176902?
The CAS number of BAS 01176902 is 316357-89-8.
What is the molecular formula of BAS 01176902?
The molecular formula of BAS 01176902 is C25H24N2OS2.
What is the molecular weight of BAS 01176902?
The molecular weight of BAS 01176902 is 432.13 g/mol.
Where can I buy BAS 01176902?
You can request a quote for BAS 01176902 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01176902?
Yes, KEHONG BIO provides custom synthesis services for BAS 01176902 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.