BAS 01051967
TL;DR: BAS 01051967 (CAS 329072-67-5) is a chemical compound with molecular formula C16H20N2O3S and molecular weight 320.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanylethyl 6-methyl-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 01051967, A1905/0080050, 2-(methylsulfanyl)ethyl 6-methyl-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 2-(methylsulfanyl)ethyl 6-methyl-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, 2-methylsulfanylethyl 6-methyl-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C16H20N2O3S |
|---|---|
| Molecular Weight | 320.12 g/mol |
| LogP | 2.52912 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 320.11948 |
| Heavy Atoms | 22 |
| Complexity | 595.9134 |
Chemical Identifiers
| CAS Number | 329072-67-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C(=C(NC(=O)N2)C)C(=O)OCCSC |
Product Overview
BAS 01051967 (CAS 329072-67-5), with molecular formula C16H20N2O3S and molecular weight 320.12 g/mol. IUPAC: 2-methylsulfanylethyl 6-methyl-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 01051967
Property Insights of BAS 01051967
The XLogP value of 2.52912 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01051967. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01051967. Following Lipinski's Rule of Five, BAS 01051967 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 01051967?
The CAS number of BAS 01051967 is 329072-67-5.
What is the molecular formula of BAS 01051967?
The molecular formula of BAS 01051967 is C16H20N2O3S.
What is the molecular weight of BAS 01051967?
The molecular weight of BAS 01051967 is 320.12 g/mol.
Where can I buy BAS 01051967?
You can request a quote for BAS 01051967 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01051967?
Yes, KEHONG BIO provides custom synthesis services for BAS 01051967 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.