3-(4-chloroanilino)-6,7-dihydro-5H-pyrrolo[1,2-c][1,3]thiazol-4-ium--bromide (1/1)
Chemical Structure Depiction of
3-(4-chloroanilino)-6,7-dihydro-5H-pyrrolo[1,2-c][1,3]thiazol-4-ium--bromide (1/1)
3-(4-chloroanilino)-6,7-dihydro-5H-pyrrolo[1,2-c][1,3]thiazol-4-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 8020-8813 |
| Compound Name: | 3-(4-chloroanilino)-6,7-dihydro-5H-pyrrolo[1,2-c][1,3]thiazol-4-ium--bromide (1/1) |
| Molecular Weight: | 331.66 |
| Molecular Formula: | C12 H12 Cl N2 S |
| Salt: | Br- |
| Smiles: | C1Cc2csc(Nc3ccc(cc3)[Cl])[n+]2C1 |
| Stereo: | ACHIRAL |
| logP: | 4.323 |
| logD: | 4.323 |
| logSw: | -4.5808 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 10.9128 |
| InChI Key: | OMSXKMZYNOVLDW-UHFFFAOYSA-O |