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1,1-Diphenyl-2-methyl-3-(2-thienylmethyleneamino)propanol

HCID 215441
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Basic information

CAS
35699-20-8
Standard SMILES
CC(CN=Cc1cccs1)C(O)(c1ccccc1)c1ccccc1
InChIKey
XCLNGAUCLKQYGB-UHFFFAOYSA-N
Molecular formula
C21H21NOS
Average molar mass
335.5 g/mol
Monoisotopic mass
335.13438547

Names & identifiers

Preferred name
1,1-Diphenyl-2-methyl-3-(2-thienylmethyleneamino)propanol
IUPAC
2-methyl-1,1-diphenyl-3-(thiophen-2-ylmethylideneamino)propan-1-ol

Names & synonyms

35699-20-8alpha-(1-Methyl-2-(2-thenylideneimino)ethyl)benzhydrol1,1-Diphenyl-2-methyl-3-(2-thienylmethyleneamino)propanolBenzhydrol, alpha-(1-methyl-2-(2-thenylideneimino)ethyl)-

Database identifiers

CAS
35699-20-8
PubChem CID
215441
Nikkaji
J62.238I

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
60.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
24
Formal charge
0
Complexity
381

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