5-(3-chloropropanoyl)-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
5-(3-chloropropanoyl)-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
5-(3-chloropropanoyl)-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | 8010-2999 |
| Compound Name: | 5-(3-chloropropanoyl)-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 266.72 |
| Molecular Formula: | C13 H15 Cl N2 O2 |
| Smiles: | CC1CC(Nc2ccccc2N1C(CC[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4386 |
| logD: | 1.3945 |
| logSw: | -2.0164 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.465 |
| InChI Key: | MSKNJYWBQAJGEB-VIFPVBQESA-N |