BAS 00435745
TL;DR: BAS 00435745 (CAS 303127-48-2) is a chemical compound with molecular formula C15H13N3OS2 and molecular weight 315.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(E)-thiophen-2-ylmethylideneamino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: BAS 00435745, BIM-0021885.P001, 3-[(E)-thiophen-2-ylmethylideneamino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, (E)-3-((thiophen-2-ylmethylene)amino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 3-((1E)-2-(2-thienyl)-1-azavinyl)-3,5,6,7,8-pentahydrobenzo[b]thiopheno[2,3-d] pyrimidin-4-one
| Molecular Formula | C15H13N3OS2 |
|---|---|
| Molecular Weight | 315.05 g/mol |
| LogP | 3.2805 |
| Topological Polar Surface Area | 47.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 315.05002 |
| Heavy Atoms | 21 |
| Complexity | 874.3412 |
Chemical Identifiers
| CAS Number | 303127-48-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=CN(C3=O)/N=C/C4=CC=CS4 |
Product Overview
BAS 00435745 (CAS 303127-48-2), with molecular formula C15H13N3OS2 and molecular weight 315.05 g/mol. IUPAC: 3-[(E)-thiophen-2-ylmethylideneamino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of BAS 00435745
Property Insights of BAS 00435745
The XLogP value of 3.2805 indicates that BAS 00435745 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.25 Ų, BAS 00435745 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00435745 has 0 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 00435745?
The CAS number of BAS 00435745 is 303127-48-2.
What is the molecular formula of BAS 00435745?
The molecular formula of BAS 00435745 is C15H13N3OS2.
What is the molecular weight of BAS 00435745?
The molecular weight of BAS 00435745 is 315.05 g/mol.
Where can I buy BAS 00435745?
You can request a quote for BAS 00435745 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00435745?
Yes, KEHONG BIO provides custom synthesis services for BAS 00435745 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.