BAS 00338204
TL;DR: BAS 00338204 (CAS 327169-66-4) is a chemical compound with molecular formula C24H21FN2OS3 and molecular weight 468.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-fluorophenyl)methylsulfanyl]-12,12-dimethyl-4-phenyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: BAS 00338204, 2-((4-fluorobenzyl)thio)-6,6-dimethyl-3-phenyl-5,6-dihydro-3H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one, 2-[(4-fluorobenzyl)sulfanyl]-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C24H21FN2OS3 |
|---|---|
| Molecular Weight | 468.08 g/mol |
| LogP | 6.4465 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 468.08002 |
| Heavy Atoms | 31 |
| Complexity | 1310.9097 |
Chemical Identifiers
| CAS Number | 327169-66-4 |
|---|---|
| SMILES | CC1(CC2=C(CS1)SC3=C2C(=O)N(C(=N3)SCC4=CC=C(C=C4)F)C5=CC=CC=C5)C |
Product Overview
BAS 00338204 (CAS 327169-66-4), with molecular formula C24H21FN2OS3 and molecular weight 468.08 g/mol. IUPAC: 5-[(4-fluorophenyl)methylsulfanyl]-12,12-dimethyl-4-phenyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of BAS 00338204
Property Insights of BAS 00338204
The XLogP value of 6.4465 indicates that BAS 00338204 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 00338204 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00338204 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00338204?
The CAS number of BAS 00338204 is 327169-66-4.
What is the molecular formula of BAS 00338204?
The molecular formula of BAS 00338204 is C24H21FN2OS3.
What is the molecular weight of BAS 00338204?
The molecular weight of BAS 00338204 is 468.08 g/mol.
Where can I buy BAS 00338204?
You can request a quote for BAS 00338204 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00338204?
Yes, KEHONG BIO provides custom synthesis services for BAS 00338204 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.