5-(butylsulfanyl)-3-(4-chlorophenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-(butylsulfanyl)-3-(4-chlorophenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-(butylsulfanyl)-3-(4-chlorophenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | F092-0140 |
| Compound Name: | 5-(butylsulfanyl)-3-(4-chlorophenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 383.94 |
| Molecular Formula: | C15 H14 Cl N3 O S3 |
| Smiles: | CCCCSC1NC(C2=C(N=1)N(C(=S)S2)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6384 |
| logD: | 4.6367 |
| logSw: | -4.7393 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.568 |
| InChI Key: | NVPKARNPPKZGBN-UHFFFAOYSA-N |