5,5-dimethyl-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one
Chemical Structure Depiction of
5,5-dimethyl-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one
5,5-dimethyl-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one
Compound characteristics
| Compound ID: | 3807-3100 |
| Compound Name: | 5,5-dimethyl-2-sulfanylidene-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one |
| Molecular Weight: | 258.34 |
| Molecular Formula: | C14 H14 N2 O S |
| Smiles: | CC1(C)Cc2ccccc2C2=C1C(NC(N2)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0626 |
| logD: | 2.8589 |
| logSw: | -3.6397 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.961 |
| InChI Key: | XMYDQZMDMBKIEW-UHFFFAOYSA-N |