BAS 00943954
TL;DR: BAS 00943954 (CAS 333767-91-2) is a chemical compound with molecular formula C20H21N3OS and molecular weight 351.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-N-(2-methylphenyl)-4-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: BAS 00943954, BIM-0032879.P001, AB00096493-01, AE-848/12918229, 6-methyl-N-(2-methylphenyl)-4-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
| Molecular Formula | C20H21N3OS |
|---|---|
| Molecular Weight | 351.14 g/mol |
| LogP | 3.73494 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.14053 |
| Heavy Atoms | 25 |
| Complexity | 855.49994 |
Chemical Identifiers
| CAS Number | 333767-91-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)NC3=CC=CC=C3C |
Product Overview
BAS 00943954 (CAS 333767-91-2), with molecular formula C20H21N3OS and molecular weight 351.14 g/mol. IUPAC: 6-methyl-N-(2-methylphenyl)-4-(4-methylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 00943954
Property Insights of BAS 00943954
The XLogP value of 3.73494 indicates that BAS 00943954 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.16 Ų, BAS 00943954 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00943954 has 3 hydrogen bond donor(s) and 2 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 00943954?
The CAS number of BAS 00943954 is 333767-91-2.
What is the molecular formula of BAS 00943954?
The molecular formula of BAS 00943954 is C20H21N3OS.
What is the molecular weight of BAS 00943954?
The molecular weight of BAS 00943954 is 351.14 g/mol.
Where can I buy BAS 00943954?
You can request a quote for BAS 00943954 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00943954?
Yes, KEHONG BIO provides custom synthesis services for BAS 00943954 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.