N-(1-isobutoxyethoxy) 2-(6-{(naphthalene-2-sulfonyl)-[2-(2-oxopyrrolidin-1-yl)ethyl]amino}-3-azabicyclo[3.1.0]hex-3-yl)pyrimidine-5-carboxamide

HCID 59367679
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Basic information

Standard SMILES
CC(C)COC(C)ONC(=O)c1cnc(N2CC3C(C2)C3N(CCN2CCCC2=O)S(=O)(=O)c2ccc3ccccc3c2)nc1
InChIKey
RVUZSQYOPANBFZ-UHFFFAOYSA-N
Molecular formula
C32H40N6O6S
Average molar mass
636.8 g/mol

Names & identifiers

Preferred name
N-(1-isobutoxyethoxy) 2-(6-{(naphthalene-2-sulfonyl)-[2-(2-oxopyrrolidin-1-yl)ethyl]amino}-3-azabicyclo[3.1.0]hex-3-yl)pyrimidine-5-carboxamide
IUPAC
N-[1-(2-methylpropoxy)ethoxy]-2-[6-[naphthalen-2-ylsulfonyl-[2-(2-oxopyrrolidin-1-yl)ethyl]amino]-3-azabicyclo[3.1.0]hexan-3-yl]pyrimidine-5-carboxamide

Names & synonyms

SCHEMBL1011612RVUZSQYOPANBFZ-UHFFFAOYSA-Nn-(1-isobutoxyethoxy) 2-(6-{(naphthalene-2-sulfonyl)-[2-(2-oxopyrrolidin-1-yl)ethyl]-amino}-3-azabicyclo[3.1.0]hex-3-yl)pyrimidine-5-carboxamideN-(1-isobutoxyethoxy) 2-(6-{(naphthalene-2-sulfonyl)-[2-(2-oxopyrrolidin-1-yl)ethyl]amino}-3-azabicyclo[3.1.0]hex-3-yl)pyrimidine-5-carboxamide

Database identifiers

PubChem CID
59367679

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
143 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
10
Rotatable bonds
13
Heavy atoms
45

Related reactions

2 records
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Compound notes

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