4-(2-(Dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)phenyl 4-methylbenzoate
[4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenyl] 4-methylbenzoate
Molecular Identity
4-(2-(Dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)phenyl 4-methylbenzoate
[4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenyl] 4-methylbenzoate
PubChem CID: 15983287
2D Structure
Properties
C24H31NO3
Molecular Formula
381.50
Molecular Weight
g/mol
381.2304
Exact Mass
Da
4.7
XLogP
Drug-like (Lipinski: < 5)
49.8
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
4
H-Bond Acceptors
484
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(CN(C)C)C3(CCCCC3)OIsomeric SMILES
SMILES: CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(CN(C)C)C3(CCCCC3)OSynonyms(20)
4-(2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)phenyl 4-methylbenzoateRefChem:190309AnsofaxineToludesvenlafaxine916918-80-4ODVP2LY-03005LY03005Toludesvenlafaxine [USAN]A7CGH459FN4-Methylbenzoate of desvenlafaxineUNII-A7CGH459FN[4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenyl] 4-methylbenzoateLPM570065 FREE BASELPM-570065 FREE BASE
Data from PubChem (NCBI)
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Molecular Structure
4-(2-(Dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)phenyl 4-methylbenzoate
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Drug Network
Trials and conditions connected to 4-(2-(Dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)phenyl 4-methylbenzoate
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