3-methoxycarbonyl-1-(7-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-indole

HCID 68968614

Basic information

Standard SMILES
COC(=O)c1cn(-c2ncnc3c2ccn3C)c2ccccc12
InChIKey
DUOFOEHMCJKIBB-UHFFFAOYSA-N
Molecular formula
C17H14N4O2
Average molar mass
306.32 g/mol

Names & identifiers

Preferred name
3-methoxycarbonyl-1-(7-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-indole
IUPAC
methyl 1-(7-methylpyrrolo[2,3-d]pyrimidin-4-yl)indole-3-carboxylate

Names & synonyms

SCHEMBL4236069DUOFOEHMCJKIBB-UHFFFAOYSA-N3-methoxycarbonyl-1-(7-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-indole3-Methoxycarbonyl-1-(7-methyl-7H-pyrrolo[2,3-d]pyrimid in-4-yl)-1H-indole

Database identifiers

PubChem CID
68968614

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
61.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
23

Related reactions

4 records

Linked notes

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