7-bromo-5-oxo-1-sulfanylidene-N-[(thiophen-2-yl)methyl]-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
7-bromo-5-oxo-1-sulfanylidene-N-[(thiophen-2-yl)methyl]-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
7-bromo-5-oxo-1-sulfanylidene-N-[(thiophen-2-yl)methyl]-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F083-0299 |
| Compound Name: | 7-bromo-5-oxo-1-sulfanylidene-N-[(thiophen-2-yl)methyl]-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
| Molecular Weight: | 452.37 |
| Molecular Formula: | C16 H10 Br N3 O2 S3 |
| Smiles: | C(c1cccs1)NC(C1=C2NC(c3cc(ccc3N2C(=S)S1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5281 |
| logD: | 3.5281 |
| logSw: | -3.9629 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.408 |
| InChI Key: | JDXJDPCRBSWDAN-UHFFFAOYSA-N |