Basic information
- CAS
97964-54-0- Standard SMILES
CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)c1ccc(C)c(C)c1- InChIKey
UPKUMLKWNJTSMG-UHFFFAOYSA-N- Molecular formula
- C24H38N2O4
- Average molar mass
- 418.6 g/mol
- Monoisotopic mass
- 418.2831577
Names & identifiers
- Preferred name
- Tomoglumide
- IUPAC
- 4-[(3,4-dimethylbenzoyl)amino]-5-(dipentylamino)-5-oxopentanoic acid
- English name
- Tomoglumide
- Molecular formula
- C24H38N2O4
- Molecular weight
- 418.574
Names & synonyms
Tomoglumide97964-54-0tomoglumida4AO61I7SLBCR-1392DTXSID40869310CR 1392(+-)-4-(3,4-Dimethylbenzamido)-N,N-dipentylglutaramic acidtomoglumidumRefChem:190377DTXCID00817312Tomoglumide [INN]
Show more names
5-(diamylamino)-4-[(3,4-dimethylbenzoyl)amino]-5-keto-valeric acid4-[(3,4-dimethylphenyl)carbonylamino]-5-(dipentylamino)-5-oxo-pentanoic acid
4-[(3,4-dimethylbenzoyl)amino]-5-(dipentylamino)-5-oxopentanoic acidUNII-4AO61I7SLB4-((3,4-dimethylbenzoyl)amino)-5-(dipentylamino)-5-oxopentanoic acidSCHEMBL2107749CHEMBL2107668NS00125746Q27259349N~2~-(3,4-Dimethylbenzoyl)-N,N-dipentyl-alpha-glutamine
Database identifiers
- CAS
97964-54-0- PubChem CID
- 65852
- DTXSID
DTXSID40869310- ChEMBL
CHEMBL2107668- UNII
- 4AO61I7SLB
- Nikkaji
- J227.545G
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 86.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 527
Physicochemical properties
- FDA UNII
- 4 AO61I7SLB · 4AO61I7SLB
Chemistry & industry
Suppliers1 total
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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