9-(5-chlorothiophene-2-sulfonyl)-N-[(2-methoxyphenyl)methyl]-1,4,9-triazaspiro[5.5]undec-4-en-5-amine
Chemical Structure Depiction of
9-(5-chlorothiophene-2-sulfonyl)-N-[(2-methoxyphenyl)methyl]-1,4,9-triazaspiro[5.5]undec-4-en-5-amine
9-(5-chlorothiophene-2-sulfonyl)-N-[(2-methoxyphenyl)methyl]-1,4,9-triazaspiro[5.5]undec-4-en-5-amine
Compound characteristics
| Compound ID: | L676-1364 |
| Compound Name: | 9-(5-chlorothiophene-2-sulfonyl)-N-[(2-methoxyphenyl)methyl]-1,4,9-triazaspiro[5.5]undec-4-en-5-amine |
| Molecular Weight: | 505.48 |
| Molecular Formula: | C20 H25 Cl N4 O3 S2 |
| Salt: | HCl |
| Smiles: | COc1ccccc1CNC1C2(CCN(CC2)S(c2ccc(s2)[Cl])(=O)=O)NCCN=1 |
| Stereo: | ACHIRAL |
| logP: | 3.1893 |
| logD: | -0.4611 |
| logSw: | -3.6447 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.015 |
| InChI Key: | ZBPFONDBOISAAV-UHFFFAOYSA-N |