N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]thiophene-2-sulfonamide
Chemical Structure Depiction of
N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]thiophene-2-sulfonamide
N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | S638-1025 |
| Compound Name: | N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]thiophene-2-sulfonamide |
| Molecular Weight: | 368.47 |
| Molecular Formula: | C15 H20 N4 O3 S2 |
| Smiles: | C1CC2=NN(CC3CC3)C(N2CCC1NS(c1cccs1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1257 |
| logD: | 2.1218 |
| logSw: | -2.5734 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.562 |
| InChI Key: | LTXVGMGBLGAPGX-LBPRGKRZSA-N |