7-chloro-5-oxo-N-pentyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
7-chloro-5-oxo-N-pentyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
7-chloro-5-oxo-N-pentyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F083-0033 |
| Compound Name: | 7-chloro-5-oxo-N-pentyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
| Molecular Weight: | 381.9 |
| Molecular Formula: | C16 H16 Cl N3 O2 S2 |
| Smiles: | CCCCCNC(C1=C2NC(c3cc(ccc3N2C(=S)S1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.598 |
| logD: | 3.5979 |
| logSw: | -4.0202 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.502 |
| InChI Key: | KZDOSGMVVWIVGF-UHFFFAOYSA-N |