5-methyl-6-(phenylcarbamoyl)-5,6-dihydro-4H-[1,3]thiazolo[3,2-a][1,5]benzodiazepin-11-ium--bromide (1/1)
Chemical Structure Depiction of
5-methyl-6-(phenylcarbamoyl)-5,6-dihydro-4H-[1,3]thiazolo[3,2-a][1,5]benzodiazepin-11-ium--bromide (1/1)
5-methyl-6-(phenylcarbamoyl)-5,6-dihydro-4H-[1,3]thiazolo[3,2-a][1,5]benzodiazepin-11-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 8015-2137 |
| Compound Name: | 5-methyl-6-(phenylcarbamoyl)-5,6-dihydro-4H-[1,3]thiazolo[3,2-a][1,5]benzodiazepin-11-ium--bromide (1/1) |
| Molecular Weight: | 416.34 |
| Molecular Formula: | C19 H18 N3 O S |
| Salt: | Br- |
| Smiles: | CC1Cc2[n+](ccs2)c2ccccc2N1C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9835 |
| logD: | 3.9835 |
| logSw: | -4.1217 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.4453 |
| InChI Key: | LQRPCYMQZDSDJD-AWEZNQCLSA-O |