BAS 01090286
TL;DR: BAS 01090286 (CAS 336170-70-8) is a chemical compound with molecular formula C19H16FN3O2S and molecular weight 369.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[4-(dimethylamino)phenyl]methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: BAS 01090286, (5E)-5-[(4-dimethylaminophenyl)methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione, (5E)-5-[4-(dimethylamino)benzylidene]-1-(4-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (5E)-5-{[4-(DIMETHYLAMINO)PHENYL]METHYLIDENE}-1-(4-FLUOROPHENYL)-2-SULFANYLIDENE-1,3-DIAZINANE-4,6-DIONE, (E)-5-(4-(dimethylamino)benzylidene)-1-(4-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C19H16FN3O2S |
|---|---|
| Molecular Weight | 369.09 g/mol |
| LogP | 2.723 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 369.09473 |
| Heavy Atoms | 26 |
| Complexity | 905.3864 |
Chemical Identifiers
| CAS Number | 336170-70-8 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=C/2\C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)F |
Product Overview
BAS 01090286 (CAS 336170-70-8), with molecular formula C19H16FN3O2S and molecular weight 369.09 g/mol. IUPAC: (5E)-5-[[4-(dimethylamino)phenyl]methylidene]-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of BAS 01090286
Property Insights of BAS 01090286
The XLogP value of 2.723 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01090286. With a topological polar surface area (TPSA) of 52.65 Ų, BAS 01090286 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01090286 has 1 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 01090286?
The CAS number of BAS 01090286 is 336170-70-8.
What is the molecular formula of BAS 01090286?
The molecular formula of BAS 01090286 is C19H16FN3O2S.
What is the molecular weight of BAS 01090286?
The molecular weight of BAS 01090286 is 369.09 g/mol.
Where can I buy BAS 01090286?
You can request a quote for BAS 01090286 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01090286?
Yes, KEHONG BIO provides custom synthesis services for BAS 01090286 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.