N-[(furan-2-yl)methyl]-N'-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)urea
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N'-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)urea
N-[(furan-2-yl)methyl]-N'-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)urea
Compound characteristics
| Compound ID: | S637-0270 |
| Compound Name: | N-[(furan-2-yl)methyl]-N'-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)urea |
| Molecular Weight: | 289.33 |
| Molecular Formula: | C14 H19 N5 O2 |
| Smiles: | Cc1nnc2CCC(CCn12)NC(NCc1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.432 |
| logD: | 0.4295 |
| logSw: | -1.5768 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.54 |
| InChI Key: | ZXANCIAJYUOZNN-NSHDSACASA-N |