C16H12ClN3O
1-(14-chloro-7-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-2-ylidene)-3-methylurea
Also Known As: Urea, (7-chloro-5H-benzo[4,5]cyclohepta[1,2-b]pyridin-5-ylidene)methyl-|5H-BENZO(4,5)CYCLOHEPTA(1,2-b)PYRIDINE, 7-CHLORO-5-((METHYLCARBAMOYL)IMINO)-|7-Chloro-5-((methylcarbamoyl)imino)-5H-benzo(4,5)cyclohepta(1,2-b)pyridine
| Molecular Formula | C16H12ClN3O |
|---|---|
| Molecular Weight | 297.0669 g/mol |
| LogP | 3.28 |
| Topological Polar Surface Area | 54.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 297.0669 |
| Heavy Atoms | 21 |
| Complexity | 921.7 |
Chemical Identifiers
| CAS Number | 36040-25-2 |
|---|---|
| SMILES | CNC(=O)N=C1C2=C(C=CC3=C1C=C(C=C3)Cl)N=CC=C2 |
Product Overview
C16H12ClN3O (CAS 36040-25-2), with molecular formula C16H12ClN3O and molecular weight 297.0669 g/mol. IUPAC: 1-(14-chloro-7-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-2-ylidene)-3-methylurea.
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