BAS 00622230
TL;DR: BAS 00622230 (CAS 331845-19-3) is a chemical compound with molecular formula C21H14N2O2S2 and molecular weight 390.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diphenyl-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-diazinane-4,6-dione
Also Known As: BAS 00622230, 1,3-diphenyl-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-diazinane-4,6-dione, 1,3-diphenyl-5-(thiophen-2-ylmethylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 1,3-diphenyl-5-(thiophen-2-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 1,3-Diphenyl-5-thiophen-2-ylmethylene-2-thioxo-dihydro-pyrimidine-4,6-dione
| Molecular Formula | C21H14N2O2S2 |
|---|---|
| Molecular Weight | 390.05 g/mol |
| LogP | 4.4964 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.04968 |
| Heavy Atoms | 27 |
| Complexity | 965.06805 |
Chemical Identifiers
| CAS Number | 331845-19-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CS3)C(=O)N(C2=S)C4=CC=CC=C4 |
Product Overview
BAS 00622230 (CAS 331845-19-3), with molecular formula C21H14N2O2S2 and molecular weight 390.05 g/mol. IUPAC: 1,3-diphenyl-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-diazinane-4,6-dione.
Chemical Property Profile of BAS 00622230
Property Insights of BAS 00622230
The XLogP value of 4.4964 indicates that BAS 00622230 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.62 Ų, BAS 00622230 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00622230 has 0 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 00622230?
The CAS number of BAS 00622230 is 331845-19-3.
What is the molecular formula of BAS 00622230?
The molecular formula of BAS 00622230 is C21H14N2O2S2.
What is the molecular weight of BAS 00622230?
The molecular weight of BAS 00622230 is 390.05 g/mol.
Where can I buy BAS 00622230?
You can request a quote for BAS 00622230 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00622230?
Yes, KEHONG BIO provides custom synthesis services for BAS 00622230 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.