BAS 00289255
TL;DR: BAS 00289255 (CAS 102609-58-5) is a chemical compound with molecular formula C16H15N3OS2 and molecular weight 329.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-benzyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
Also Known As: BAS 00289255, BIM-0015973.P001, 7-benzyl-2-thioxo-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one, 7-benzyl-2-sulfanyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 7-benzyl-2-sulfanyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
| Molecular Formula | C16H15N3OS2 |
|---|---|
| Molecular Weight | 329.07 g/mol |
| LogP | 3.20549 |
| Topological Polar Surface Area | 51.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 329.06564 |
| Heavy Atoms | 22 |
| Complexity | 939.4196 |
Chemical Identifiers
| CAS Number | 102609-58-5 |
|---|---|
| SMILES | C1CN(CC2=C1C3=C(S2)NC(=S)NC3=O)CC4=CC=CC=C4 |
Product Overview
BAS 00289255 (CAS 102609-58-5), with molecular formula C16H15N3OS2 and molecular weight 329.07 g/mol. IUPAC: 11-benzyl-5-sulfanylidene-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one.
Chemical Property Profile of BAS 00289255
Property Insights of BAS 00289255
The XLogP value of 3.20549 indicates that BAS 00289255 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.89 Ų, BAS 00289255 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00289255 has 2 hydrogen bond donor(s) and 4 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 00289255?
The CAS number of BAS 00289255 is 102609-58-5.
What is the molecular formula of BAS 00289255?
The molecular formula of BAS 00289255 is C16H15N3OS2.
What is the molecular weight of BAS 00289255?
The molecular weight of BAS 00289255 is 329.07 g/mol.
Where can I buy BAS 00289255?
You can request a quote for BAS 00289255 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00289255?
Yes, KEHONG BIO provides custom synthesis services for BAS 00289255 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.