BAS 07023818
TL;DR: BAS 07023818 (CAS 694473-32-0) is a chemical compound with molecular formula C16H18N4O2S and molecular weight 330.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)acetamide
Also Known As: BAS 07023818, 2-(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)acetamide, 2-[(1-ALLYL-6-AMINO-4-OXO-1,4-DIHYDRO-2-PYRIMIDINYL)SULFANYL]-N~1~-(4-METHYLPHENYL)ACETAMIDE, 2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
| Molecular Formula | C16H18N4O2S |
|---|---|
| Molecular Weight | 330.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 330.11505 |
| Heavy Atoms | 23 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 694473-32-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2CC=C)N |
| InChIKey | OHEMJXWFOAUWGG-UHFFFAOYSA-N |
Product Overview
BAS 07023818 (CAS 694473-32-0), with molecular formula C16H18N4O2S and molecular weight 330.12 g/mol. IUPAC: 2-(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanyl-N-(4-methylphenyl)acetamide.
Chemical Property Profile of BAS 07023818
Property Insights of BAS 07023818
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07023818. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07023818. Following Lipinski's Rule of Five, BAS 07023818 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 07023818?
The CAS number of BAS 07023818 is 694473-32-0.
What is the molecular formula of BAS 07023818?
The molecular formula of BAS 07023818 is C16H18N4O2S.
What is the molecular weight of BAS 07023818?
The molecular weight of BAS 07023818 is 330.12 g/mol.
Where can I buy BAS 07023818?
You can request a quote for BAS 07023818 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07023818?
Yes, KEHONG BIO provides custom synthesis services for BAS 07023818 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.