N-cycloheptyl-4-{[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]methyl}benzamide
Chemical Structure Depiction of
N-cycloheptyl-4-{[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]methyl}benzamide
N-cycloheptyl-4-{[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]methyl}benzamide
Compound characteristics
| Compound ID: | K297-0712 |
| Compound Name: | N-cycloheptyl-4-{[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]methyl}benzamide |
| Molecular Weight: | 406.55 |
| Molecular Formula: | C23 H26 N4 O S |
| Smiles: | C1CCCC(CC1)NC(c1ccc(CNC2c3ccccc3NC(N=2)=S)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1123 |
| logD: | 2.3016 |
| logSw: | -4.3661 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 55.532 |
| InChI Key: | FYBQZERDUGXEIQ-UHFFFAOYSA-N |