3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]propanamide
Chemical Structure Depiction of
3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]propanamide
3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]propanamide
Compound characteristics
Compound ID: | J101-0201 |
Compound Name: | 3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]propanamide |
Molecular Weight: | 407.45 |
Molecular Formula: | C20 H17 N5 O3 S |
Smiles: | C(C[C@@H]1C(Nc2ccccc2C(N1)=O)=O)C(Nc1nc(cs1)c1ccccn1)=O |
Stereo: | ABSOLUTE |
logP: | 2.5866 |
logD: | 2.576 |
logSw: | -3.3821 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 92.923 |
InChI Key: | ONAFIBWMFUOFME-OAHLLOKOSA-N |