Fosigotifator sodium tromethamine
sodium;2-amino-2-(hydroxymethyl)propane-1,3-diol;[(2S)-1,4-bis[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-2-bicyclo[2.2.2]octanyl]oxymethyl hydrogen phosphate
Molecular Identity
Fosigotifator sodium tromethamine
sodium;2-amino-2-(hydroxymethyl)propane-1,3-diol;[(2S)-1,4-bis[[2-(4-chloro-3-fluorophenoxy)acetyl]amino]-2-bicyclo[2.2.2]octanyl]oxymethyl hydrogen phosphate
PubChem CID: 166177193
2D Structure
Properties
C29H37Cl2F2N3NaO12P
Molecular Formula
782.50
Molecular Weight
g/mol
781.1358
Exact Mass
Da
242
TPSA
May have limited oral absorption
7
H-Bond Donors
15
H-Bond Acceptors
1040
Complexity
SMILES
Canonical SMILES
SMILES: C1CC2(CCC1(CC2OCOP(=O)(O)[O-])NC(=O)COC3=CC(=C(C=C3)Cl)F)NC(=O)COC4=CC(=C(C=C4)Cl)F.C(C(CO)(CO)N)O.[Na+]Isomeric SMILES
SMILES: C1CC2(CCC1(C[C@@H]2OCOP(=O)(O)[O-])NC(=O)COC3=CC(=C(C=C3)Cl)F)NC(=O)COC4=CC(=C(C=C4)Cl)F.C(C(CO)(CO)N)O.[Na+]Synonyms(12)
ABBV-CLS-7262Fosigotifator sodium tromethamineBN9FN5629V2945073-88-9RefChem:1085555Fosigotifator sodium tromethamine (USAN)FOSIGOTIFATOR SODIUM TROMETHAMINE [USAN]CHEMBL5314908EX-A7829HY-153399ACS-1097804D13119
Data from PubChem (NCBI)
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