Udifitimod
[(1R,3S)-1-amino-3-[(6S)-6-[2-(2-methoxyphenyl)ethyl]-5,6,7,8-tetrahydronaphthalen-2-yl]cyclopentyl]methanol
Molecular Identity
Udifitimod
[(1R,3S)-1-amino-3-[(6S)-6-[2-(2-methoxyphenyl)ethyl]-5,6,7,8-tetrahydronaphthalen-2-yl]cyclopentyl]methanol
PubChem CID: 118877516
2D Structure
Properties
C25H33NO2
Molecular Formula
379.50
Molecular Weight
g/mol
379.2511
Exact Mass
Da
4.6
XLogP
Drug-like (Lipinski: < 5)
55.5
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
3
H-Bond Acceptors
497
Complexity
SMILES
Canonical SMILES
SMILES: COC1=CC=CC=C1CCC2CCC3=C(C2)C=CC(=C3)C4CCC(C4)(CO)NIsomeric SMILES
SMILES: COC1=CC=CC=C1CC[C@@H]2CCC3=C(C2)C=CC(=C3)[C@H]4CC[C@@](C4)(CO)NSynonyms(20)
UdifitimodBMS-9861661883345-06-9283FTA936D[(1R,3S)-1-amino-3-[(6S)-6-[2-(2-methoxyphenyl)ethyl]-5,6,7,8-tetrahydronaphthalen-2-yl]cyclopentyl]methanolCyclopentanemethanol, 1-amino-3-((6S)-5,6,7,8-tetrahydro-6-(2-(2-methoxyphenyl)ethyl)-2-naphthalenyl)-, (1R,3S)-((1R,3S)-1-amino-3-((6S)-6-(2-(2-methoxyphenyl)ethyl)-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopentyl)methanolCyclopentanemethanol, 1-amino-3-[(6S)-5,6,7,8-tetrahydro-6-[2-(2-methoxyphenyl)ethyl]-2-naphthalenyl]-, (1R,3S)-RefChem:120772Udifitimod [USAN]UNII-283FTA936DUdifitimod (USAN)WHO 12137((1R,3S)-1-amino-3-((S)-6-(2-methoxyphenethyl)-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopentyl)methanoludifitimod [INN]
Data from PubChem (NCBI)
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