2460249-19-6
[(1R,3S)-3-[3-[[3-(methoxymethyl)-1-methylpyrazole-5-carbonyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-propan-2-ylcarbamate
Molecular Identity
2460249-19-6
[(1R,3S)-3-[3-[[3-(methoxymethyl)-1-methylpyrazole-5-carbonyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-propan-2-ylcarbamate
PubChem CID: 154616422
2D Structure
Properties
C19H28N6O4
Molecular Formula
404.50
Molecular Weight
g/mol
404.2172
Exact Mass
Da
1.2
XLogP
Drug-like (Lipinski: < 5)
123
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
6
H-Bond Acceptors
577
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
2460249-19-6PF-07104091TagtociclibTegtociclibPF07104091XBD0JF5EHJRefChem:1099422PF 07104091(1R,3S)-3-(5-(((3-(Methoxymethyl)-1-methyl-1H-pyrazol-5-yl)carbonyl)amino)-1H-pyrazol-3-yl)cyclopentyl N-(1-methylethyl)carbamate(1R,3S)-3-(5-(3-(methoxymethyl)-1-methyl-1H-pyrazole-5carboxamido)-1H-pyrazol-3-yl)cyclopentyl (propan-2yl)carbamateTegtociclib (USAN)TEGTOCICLIB [USAN](1R,3S)-3-(3-(3-(methoxymethyl)-1-methyl-1H-pyrazole-5-carboxamido)-1H-pyrazol-5-yl)cyclopentyl isopropylcarbamate(1R,3S)-3-(5-(3-(Methoxymethyl)-1-methyl-1H-pyrazole-5-carboxamido)-1H-pyrazol-3-yl)cyclopentyl isopropylcarbamate[(1R,3S)-3-[3-[[5-(methoxymethyl)-2-methylpyrazole-3-carbonyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-propan-2-ylcarbamate
Data from PubChem (NCBI)
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