Morpholine, 4-((1-(p-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazol-3-yl)thioacetyl)-
Basic information
- CAS
21484-49-1- Standard SMILES
S=C(Cc1nn(-c2ccc(Cl)cc2)c2c1CCCC2)N1CCOCC1- InChIKey
GUABHVNMJBHHFR-UHFFFAOYSA-N- Molecular formula
- C19H22ClN3OS
- Average molar mass
- 375.9 g/mol
- Monoisotopic mass
- 375.1172112
Names & identifiers
- Preferred name
- Morpholine, 4-((1-(p-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazol-3-yl)thioacetyl)-
- IUPAC
- 2-[1-(4-chlorophenyl)-4,5,6,7-tetrahydroindazol-3-yl]-1-morpholin-4-ylethanethione
Names & synonyms
Poli 49BRN 1035491Morpholine, 4-((1-(p-chlorophenyl)-4,5,6,7-tetrahydro-1H-indazol-3-yl)thioacetyl)-DTXSID301757754-((1-(p-Chlorophenyl)-4,5,6,7-tetrahydro-1H-indazol-3-yl)thioacetyl)morpholineRefChem:357541DTXCID509826621484-49-12-[1-(4-Chlorophenyl)-4,5,6,7-tetrahydro-1H-indazol-3-yl]-1-(morpholin-4-yl)ethane-1-thione
Database identifiers
- CAS
21484-49-1- PubChem CID
- 210668
- DTXSID
DTXSID30175775
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 62.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 466
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Compound notes
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