1,5-bis(3-bromopropanoyl)-4-methyl-7-nitro-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
1,5-bis(3-bromopropanoyl)-4-methyl-7-nitro-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
1,5-bis(3-bromopropanoyl)-4-methyl-7-nitro-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | 8010-3039 |
| Compound Name: | 1,5-bis(3-bromopropanoyl)-4-methyl-7-nitro-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 491.13 |
| Molecular Formula: | C16 H17 Br2 N3 O5 |
| Smiles: | CC1CC(N(C(CC[Br])=O)c2ccc(cc2N1C(CC[Br])=O)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7318 |
| logD: | 1.7318 |
| logSw: | -2.2241 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.735 |
| InChI Key: | BNYOUTCTHDQYRG-SNVBAGLBSA-N |