3-[(2-chlorophenyl)methyl]-N-[2-(cyclohex-1-en-1-yl)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-N-[2-(cyclohex-1-en-1-yl)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-[(2-chlorophenyl)methyl]-N-[2-(cyclohex-1-en-1-yl)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K284-0037 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-N-[2-(cyclohex-1-en-1-yl)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 453.99 |
| Molecular Formula: | C24 H24 Cl N3 O2 S |
| Smiles: | C1CCC(CCNC(c2ccc3C(N(Cc4ccccc4[Cl])C(Nc3c2)=S)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.8638 |
| logD: | 4.8632 |
| logSw: | -4.9774 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.765 |
| InChI Key: | LDSNHHXZKDCHAI-UHFFFAOYSA-N |