N-[(3-methoxyphenyl)methyl]-9-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-9-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine
N-[(3-methoxyphenyl)methyl]-9-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine
Compound characteristics
| Compound ID: | L676-1414 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-9-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine |
| Molecular Weight: | 519.11 |
| Molecular Formula: | C26 H34 N4 O3 S |
| Salt: | HCl |
| Smiles: | COc1cccc(CNC2C3(CCN(CC3)S(c3ccc4CCCCc4c3)(=O)=O)NCCN=2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0246 |
| logD: | 0.2504 |
| logSw: | -4.0734 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.83 |
| InChI Key: | JZUKPONISJGIOH-UHFFFAOYSA-N |