6-N-(2-tert-butyltetrazol-5-yl)-2-N-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-4H-3,1-benzoxazine-2,6-diamine

HCID 178488334
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Basic information

Standard SMILES
COc1cccc2c1C(NC1=Nc3ccc(Nc4nnn(C(C)(C)C)n4)cc3CO1)CC2
InChIKey
KQRZJHSGEVBINL-UHFFFAOYSA-N
Molecular formula
C23H27N7O2
Average molar mass
433.5 g/mol
Monoisotopic mass
433.22262313

Names & identifiers

IUPAC
6-N-(2-tert-butyltetrazol-5-yl)-2-N-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-4H-3,1-benzoxazine-2,6-diamine

Database identifiers

PubChem CID
59231814

Properties

Computed structural properties

XLogP
4
Topological polar surface area
98.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
32

Related reactions

1 records
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Compound notes

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