{2-[5-(2-tert-Butoxycarbonylaminoethylcarbamoyl)-pentylcarbamoyl]ethyl}-carbamic acid benzyl ester

HCID 69296149
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Basic information

Standard SMILES
CC(C)(C)OC(=O)NCCNC(=O)CCCCCNC(=O)CCNC(=O)OCc1ccccc1
InChIKey
VAPRQMXIVHFOGO-UHFFFAOYSA-N
Molecular formula
C24H38N4O6
Average molar mass
478.6 g/mol
Monoisotopic mass
478.27913494

Names & identifiers

Preferred name
{2-[5-(2-tert-Butoxycarbonylaminoethylcarbamoyl)-pentylcarbamoyl]ethyl}-carbamic acid benzyl ester
IUPAC
benzyl N-[3-[[6-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-6-oxohexyl]amino]-3-oxopropyl]carbamate

Names & synonyms

SCHEMBL5057110VAPRQMXIVHFOGO-UHFFFAOYSA-N{2-[5-(2-tert-Butoxycarbonylaminoethylcarbamoyl)-pentylcarbamoyl]ethyl}-carbamic acid benzyl ester

Database identifiers

PubChem CID
69296149

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
135 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
17
Heavy atoms
34

Related reactions

2 records
New reaction record

Compound notes

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