[11C]Phno
(10bR)-4-(111C)propyl-2,3,4a,5,6,10b-hexahydrobenzo[h][1,4]benzoxazin-9-ol
Molecular Identity
[11C]Phno
(10bR)-4-(111C)propyl-2,3,4a,5,6,10b-hexahydrobenzo[h][1,4]benzoxazin-9-ol
PubChem CID: 6420205
2D Structure
Properties
C15H21NO2
Molecular Formula
246.33
Molecular Weight
g/mol
246.1687
Exact Mass
Da
2.4
XLogP
Drug-like (Lipinski: < 5)
32.7
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
284
Complexity
SMILES
Canonical SMILES
SMILES: CCCN1CCOC2C1CCC3=C2C=C(C=C3)OIsomeric SMILES
SMILES: CC[11CH2]N1CCO[C@H]2C1CCC3=C2C=C(C=C3)OSynonyms(5)
[11C]PHNOSCHEMBL29525278(10Br)-4-(111C)propyl-2,3,4a,5,6,10b-hexahydrobenzo[h][1,4]benzoxazin-9-ol11C](+)-4-n-Propyl-,3,4a,5,6,10b-hexahydro-2H-naphth[1,2-b][1,4]-oxazin-9-ol[11C](+)-4-Propyl-9-hydroxy-1,2,3,4a, 5,6-hexahydronaphthoxazine, [11C](+)-4-propyl-9-hydroxynaphthoxazine
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to [11C]Phno
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