N-cyclopentyl-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-3,7,11-triazaspiro[5.6]dodec-11-en-12-amine
Chemical Structure Depiction of
N-cyclopentyl-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-3,7,11-triazaspiro[5.6]dodec-11-en-12-amine
N-cyclopentyl-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-3,7,11-triazaspiro[5.6]dodec-11-en-12-amine
Compound characteristics
| Compound ID: | CM4115-0229 |
| Compound Name: | N-cyclopentyl-3-(4-fluoro-3-methylbenzene-1-sulfonyl)-3,7,11-triazaspiro[5.6]dodec-11-en-12-amine |
| Molecular Weight: | 422.56 |
| Molecular Formula: | C21 H31 F N4 O2 S |
| Smiles: | Cc1cc(ccc1F)S(N1CCC2(CC1)C(NC1CCCC1)=NCCCN2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3357 |
| logD: | 0.4168 |
| logSw: | -3.699 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.788 |
| InChI Key: | OKFYUGDCEOLAHW-UHFFFAOYSA-N |