Basic information
- CAS
99991-93-2- Standard SMILES
CCCCNc1c(N)n(CCC)c(=O)[nH]c1=O- InChIKey
NRFSRNQYQZSBOL-UHFFFAOYSA-N- Molecular formula
- C11H20N4O2
- Average molar mass
- 240.3 g/mol
- Monoisotopic mass
- 240.15862589
Overview
6-amino-5-(butylamino)-1-propylpyrimidine-2,4-dione is a pyrimidone.
Names & identifiers
- Preferred name
- 6-Amino-5-(butylamino)-1-propylpyrimidine-2,4(1H,3H)-dione
- IUPAC
- 6-amino-5-(butylamino)-1-propylpyrimidine-2,4-dione
- English name
- 6-AMINO-5-(BUTYLAMINO)-1-PROPYLPYRIMIDINE-2,4(1H,3H)-DIONE
- Molecular formula
- C11H20N4O2
- Molecular weight
- 240.3
Names & synonyms
99991-93-26-amino-5-(butylamino)-1-propylpyrimidine-2,4(1H,3H)-dioneDTXSID60368491RefChem:307131DTXCID603195296-amino-5-(butylamino)-1-propylpyrimidine-2,4-dione6-amino-5-(butylamino)-1-propyl-1,2,3,4-tetrahydropyrimidine-2,4-dioneMLS001006903CHEMBL1466821CHEBI:114635HMS2677A18ZDA99193
Show more names
6-amino-5-butylamino-1-propyl-1H-pyrimidine-2,4-dione2,4(1H,3H)-Pyrimidinedione, 6-amino-5-(butylamino)-1-propyl-
AKOS008961979SB59427SMR000384373DB-350356EN300-06836G37277Q27196039Z55848491
Database identifiers
- CAS
99991-93-2- PubChem CID
- 2398074
- DTXSID
DTXSID60368491- ChEMBL
CHEMBL1466821- ChEBI
CHEBI:114635
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 87.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 338
Experimental & physicochemical properties
Solubility>36 [ug/mL] (The mean of the results at pH 7.4)
Chemistry & industry
Suppliers3 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]
Additional notes
DefinitionChEBI: 6-amino-5-(butylamino)-1-propylpyrimidine-2,4-dione is a pyrimidone.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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