BAS 00327947
TL;DR: BAS 00327947 (CAS 294195-79-2) is a chemical compound with molecular formula C17H19N3OS and molecular weight 313.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(6-methyl-2-methylsulfanyl-5-prop-2-enylpyrimidin-4-yl)amino]phenyl]ethanone
Also Known As: BAS 00327947, 1-[4-[(6-methyl-2-methylsulfanyl-5-prop-2-enylpyrimidin-4-yl)amino]phenyl]ethanone, AE-848/31942038, 1-[4-[[6-methyl-2-(methylthio)-5-prop-2-enyl-4-pyrimidinyl]amino]phenyl]ethanone, 1-(4-{[5-allyl-6-methyl-2-(methylsulfanyl)-4-pyrimidinyl]amino}phenyl)ethanone
| Molecular Formula | C17H19N3OS |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 4.18162 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.12488 |
| Heavy Atoms | 22 |
| Complexity | 695.7954 |
Chemical Identifiers
| CAS Number | 294195-79-2 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)SC)NC2=CC=C(C=C2)C(=O)C)CC=C |
Product Overview
BAS 00327947 (CAS 294195-79-2), with molecular formula C17H19N3OS and molecular weight 313.12 g/mol. IUPAC: 1-[4-[(6-methyl-2-methylsulfanyl-5-prop-2-enylpyrimidin-4-yl)amino]phenyl]ethanone.
Chemical Property Profile of BAS 00327947
Property Insights of BAS 00327947
The XLogP value of 4.18162 indicates that BAS 00327947 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, BAS 00327947 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00327947 has 1 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 00327947?
The CAS number of BAS 00327947 is 294195-79-2.
What is the molecular formula of BAS 00327947?
The molecular formula of BAS 00327947 is C17H19N3OS.
What is the molecular weight of BAS 00327947?
The molecular weight of BAS 00327947 is 313.12 g/mol.
Where can I buy BAS 00327947?
You can request a quote for BAS 00327947 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00327947?
Yes, KEHONG BIO provides custom synthesis services for BAS 00327947 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.