N-(3-{3-[(2-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(3-{3-[(2-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)thiophene-2-carboxamide
N-(3-{3-[(2-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V028-6709 |
| Compound Name: | N-(3-{3-[(2-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)thiophene-2-carboxamide |
| Molecular Weight: | 416.5 |
| Molecular Formula: | C23 H20 N4 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(Cc2ccccc2C#N)C(N(C1)c1cccc(c1)NC(c1cccs1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3227 |
| logD: | 4.3226 |
| logSw: | -4.2488 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.963 |
| InChI Key: | UVPDLOBIWDCDJG-UHFFFAOYSA-N |