PTC299
(4-chlorophenyl) (1S)-6-chloro-1-(4-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate
Molecular Identity
PTC299
(4-chlorophenyl) (1S)-6-chloro-1-(4-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate
PubChem CID: 49787172
2D Structure
Properties
C25H20Cl2N2O3
Molecular Formula
467.30
Molecular Weight
g/mol
466.0851
Exact Mass
Da
6.3
XLogP
Above Lipinski threshold
54.6
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
651
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
PTC299Emvododstat1256565-36-2PTC-299(4-chlorophenyl) (1S)-6-chloro-1-(4-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxylate053QD2I96A(4-chlorophenyl) (1S)-6-chloro-1-(4-methoxyphenyl)-1,3,4,9-tetrahydropyrido(3,4-b)indole-2-carboxylateRefChem:1367286-chloro-1,3,4,9-tetrahydro-1-(4-methoxyphenyl)-, 4-chlorophenyl ester, (1S)-2H-pyrido(3,4-b)indole-2-carboxylic acid4-CHLOROPHENYL (S)-6-CHLORO-1-(4-METHOXYPHENYL)-1,3,4,9-TETRAHYDRO-2H-PYRIDO[3,4-B]INDOLE-2-CARBOXYLATEEmvododstat (USAN)Emvododstat [USAN]PTC 2991219951-09-3EMVODODSTAT [INN]
Data from PubChem (NCBI)
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Drug Network
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