BAS 00758918
TL;DR: BAS 00758918 (CAS 333341-31-4) is a chemical compound with molecular formula C16H14BrN3OS and molecular weight 375.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-bromophenyl)methylideneamino]-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-one
Also Known As: BAS 00758918, 3-((3-Bromobenzylidene)amino)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4(3H)-one, 3-[(3-bromophenyl)methylideneamino]-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-one, 3-[(E)-[(3-bromophenyl)methylidene]amino]-2,5,6-trimethyl-3H,4H-thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C16H14BrN3OS |
|---|---|
| Molecular Weight | 375.00 g/mol |
| LogP | 4.02796 |
| Topological Polar Surface Area | 47.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 375.0041 |
| Heavy Atoms | 22 |
| Complexity | 955.9147 |
Chemical Identifiers
| CAS Number | 333341-31-4 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N(C(=N2)C)N=CC3=CC(=CC=C3)Br)C |
Product Overview
BAS 00758918 (CAS 333341-31-4), with molecular formula C16H14BrN3OS and molecular weight 375.00 g/mol. IUPAC: 3-[(3-bromophenyl)methylideneamino]-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of BAS 00758918
Property Insights of BAS 00758918
The XLogP value of 4.02796 indicates that BAS 00758918 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 00758918 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00758918 has 0 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 00758918?
The CAS number of BAS 00758918 is 333341-31-4.
What is the molecular formula of BAS 00758918?
The molecular formula of BAS 00758918 is C16H14BrN3OS.
What is the molecular weight of BAS 00758918?
The molecular weight of BAS 00758918 is 375.00 g/mol.
Where can I buy BAS 00758918?
You can request a quote for BAS 00758918 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00758918?
Yes, KEHONG BIO provides custom synthesis services for BAS 00758918 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.