Methyl (3-(3-iodo-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)propyl)carbamate

HCID 68309959
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Basic information

Standard SMILES
COC(=O)NCCCn1nc(I)c2ccc(C)nc21
InChIKey
SQZQRDJOFPVVIC-UHFFFAOYSA-N
Molecular formula
C12H15IN4O2
Average molar mass
374.18 g/mol

Names & identifiers

Preferred name
Methyl (3-(3-iodo-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)propyl)carbamate
IUPAC
methyl N-[3-(3-iodo-6-methylpyrazolo[5,4-b]pyridin-1-yl)propyl]carbamate

Names & synonyms

Methyl (3-(3-iodo-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)propyl)carbamatemethyl [3-(3-iodo-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)propyl]carbamateSCHEMBL12525869SQZQRDJOFPVVIC-UHFFFAOYSA-NDB-142568methyl[3-(3-iodo-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)propyl]carbamate1399850-98-6

Database identifiers

PubChem CID
68309959

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
69 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
19

Related reactions

1 records
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Compound notes

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Methyl (3-(3-iodo-6-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)propyl)carbamate (HCID 68309959)｜Huagongshe