tert-butyl {(1S)-2-[2-amino-3-(aminocarbonyl)-9h-pyrido[2,3-b]indol-9-yl]-1-methylethyl}carbamate

HCID 59513639

Basic information

Standard SMILES
C[C@@H](Cn1c2ccccc2c2cc(C(N)=O)c(N)nc21)NC(=O)OC(C)(C)C
InChIKey
BJTJYEYFMPJTSA-NSHDSACASA-N
Molecular formula
C20H25N5O3
Average molar mass
383.4 g/mol
Monoisotopic mass
383.19573968

Names & identifiers

Preferred name
tert-butyl {(1S)-2-[2-amino-3-(aminocarbonyl)-9h-pyrido[2,3-b]indol-9-yl]-1-methylethyl}carbamate
IUPAC
tert-butyl N-[(2S)-1-(2-amino-3-carbamoylpyrido[2,3-b]indol-9-yl)propan-2-yl]carbamate

Names & synonyms

SCHEMBL10148282BJTJYEYFMPJTSA-NSHDSACASA-Ntert-butyl {(1S)-2-[2-amino-3-(aminocarbonyl)-9h-pyrido[2,3-b]indol-9-yl]-1-methylethyl}carbamatetert-butyl{(1S)-2-[2-amino-3-(aminocarbonyl)-9h-pyrido[2,3-b]indol-9-yl]-1-methylethyl}carbamate

Database identifiers

PubChem CID
59513639

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
125 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
28

Related reactions

4 records

Compound notes

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