N-[(3,5-difluorophenyl)methyl]-9-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[(3,5-difluorophenyl)methyl]-9-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1)
N-[(3,5-difluorophenyl)methyl]-9-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | L676-1384 |
| Compound Name: | N-[(3,5-difluorophenyl)methyl]-9-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 525.06 |
| Molecular Formula: | C25 H30 F2 N4 O2 S |
| Salt: | HCl |
| Smiles: | C1CCc2cc(ccc2C1)S(N1CCC2(CC1)C(NCc1cc(cc(c1)F)F)=NCCN2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4603 |
| logD: | 0.6861 |
| logSw: | -4.2957 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.286 |
| InChI Key: | ZCTBOMVEAKWWFO-UHFFFAOYSA-N |