ethyl 3-[(4-amino-1,3,5-triazaspiro[5.5]undeca-2,4-dien-2-yl)amino]benzoate
Chemical Structure Depiction of
ethyl 3-[(4-amino-1,3,5-triazaspiro[5.5]undeca-2,4-dien-2-yl)amino]benzoate
ethyl 3-[(4-amino-1,3,5-triazaspiro[5.5]undeca-2,4-dien-2-yl)amino]benzoate
Compound characteristics
| Compound ID: | 5300-0264 |
| Compound Name: | ethyl 3-[(4-amino-1,3,5-triazaspiro[5.5]undeca-2,4-dien-2-yl)amino]benzoate |
| Molecular Weight: | 329.4 |
| Molecular Formula: | C17 H23 N5 O2 |
| Smiles: | CCOC(c1cccc(c1)NC1NC2(CCCCC2)N=C(N)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0186 |
| logD: | -1.0482 |
| logSw: | -3.287 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 83.64 |
| InChI Key: | IQDAWMWSGXPSNV-UHFFFAOYSA-N |