N~1~,N~1~-Diethyl-N~3~-(5-iodo-1H-indazol-3-yl)propane-1,3-diamine

HCID 20135848

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Basic information

CAS
89443-54-9
Standard SMILES
CCN(CC)CCCNc1n[nH]c2ccc(I)cc12
InChIKey
CMISLGDBFLVUJB-UHFFFAOYSA-N
Molecular formula
C14H21IN4
Average molar mass
372.25 g/mol
Monoisotopic mass
372.08109467

Names & identifiers

Preferred name
N~1~,N~1~-Diethyl-N~3~-(5-iodo-1H-indazol-3-yl)propane-1,3-diamine
IUPAC
N',N'-diethyl-N-(5-iodo-1H-indazol-3-yl)propane-1,3-diamine

Names & synonyms

89443-54-9SCHEMBL10367980DTXSID90602850CMISLGDBFLVUJB-UHFFFAOYSA-NN~1~,N~1~-Diethyl-N~3~-(5-iodo-1H-indazol-3-yl)propane-1,3-diamine3-(3-diethylaminopropylamino)-5-iodoindazole

Database identifiers

CAS
89443-54-9
PubChem CID
20135848
DTXSID
DTXSID90602850

Properties

Computed structural propertiesFilling in

XLogP
3.6
Topological polar surface area
44 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
19

Related reactions

10 records

Compound notes

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