Basic information
- CAS
405279-61-0- Standard SMILES
Nc1c(C(=O)NCc2ccccc2)nnn1Cc1ccccc1- InChIKey
GZIMZFHMSLGJTE-UHFFFAOYSA-N- Molecular formula
- C17H17N5O
- Average molar mass
- 307.35 g/mol
- Monoisotopic mass
- 307.14331018
Names & identifiers
- Preferred name
- 5-Amino-N,1-dibenzyl-1H-1,2,3-triazole-4-carboxamide
- IUPAC
- 5-amino-N,1-dibenzyltriazole-4-carboxamide
- English name
- 5-Amino-N,1-dibenzyl-1H-1,2,3-triazole-4-carboxamide
- Molecular formula
- C17H17N5O
- Molecular weight
- 307.35
Names & synonyms
5-Amino-N,1-dibenzyl-1H-1,2,3-triazole-4-carboxamide405279-61-0DTXSID40340159RefChem:301060DTXCID102912405-Amino-N'-4',1-dibenzyl-1H-1,2,3-triazole-4-carboxamide5-amino-N,1-dibenzyltriazole-4-carboxamide[5-amino-1-benzyl(1,2,3-triazol-4-yl)]-N-benzylcarboxamideOprea1_489740MLS000103485CHEMBL1359857GZIMZFHMSLGJTE-UHFFFAOYSA-N
Show more names
1H-1,2,3-Triazole-4-carboxamide, 5-amino-N,1-bis(phenylmethyl)-
HMS1626F02HMS2250G05MFCD02641271SBB002097STK764524AKOS001842752SMR000016569ST069128
Database identifiers
- CAS
405279-61-0- PubChem CID
- 562160
- DTXSID
DTXSID40340159- ChEMBL
CHEMBL1359857
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 85.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 379
Physicochemical properties
- Hazard Note
- Irritant
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_note
- Irritant
Chemistry & industry
Suppliers2 total
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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