BAS 00340287
TL;DR: BAS 00340287 (CAS 313660-77-4) is a chemical compound with molecular formula C20H20N2O2S and molecular weight 352.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(1,2-dihydroacenaphthylen-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00340287, ethyl 4-(1,2-dihydro-5-acenaphthylenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, ethyl 4-(1,2-dihydroacenaphthylen-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate, 4-Acenaphthen-5-yl-6-methyl-2-thioxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic, ethyl 6-acenaphthen-5-yl-4-methyl-2-thioxo-1,3,6-trihydropyrimidine-5-carboxyl ate
| Molecular Formula | C20H20N2O2S |
|---|---|
| Molecular Weight | 352.12 g/mol |
| LogP | 3.2943 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.12454 |
| Heavy Atoms | 25 |
| Complexity | 922.4332 |
Chemical Identifiers
| CAS Number | 313660-77-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=S)NC1C2=CC=C3CCC4=C3C2=CC=C4)C |
Product Overview
BAS 00340287 (CAS 313660-77-4), with molecular formula C20H20N2O2S and molecular weight 352.12 g/mol. IUPAC: ethyl 4-(1,2-dihydroacenaphthylen-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00340287
Property Insights of BAS 00340287
The XLogP value of 3.2943 indicates that BAS 00340287 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, BAS 00340287 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00340287 has 2 hydrogen bond donor(s) and 3 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 00340287?
The CAS number of BAS 00340287 is 313660-77-4.
What is the molecular formula of BAS 00340287?
The molecular formula of BAS 00340287 is C20H20N2O2S.
What is the molecular weight of BAS 00340287?
The molecular weight of BAS 00340287 is 352.12 g/mol.
Where can I buy BAS 00340287?
You can request a quote for BAS 00340287 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00340287?
Yes, KEHONG BIO provides custom synthesis services for BAS 00340287 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.