3-[1-(ethylsulfonyl)-4-piperidinyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-7-carboxamide

HCID 59828929

Basic information

Standard SMILES
CCS(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(B4OC(C)(C)C(C)(C)O4)cc23)CC1
InChIKey
JQGPTWOSQMRKLG-UHFFFAOYSA-N
Molecular formula
C22H32BN3O5S
Average molar mass
461.4 g/mol

Names & identifiers

Preferred name
3-[1-(ethylsulfonyl)-4-piperidinyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-7-carboxamide
IUPAC
3-(1-ethylsulfonylpiperidin-4-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-7-carboxamide

Names & synonyms

SCHEMBL553092JQGPTWOSQMRKLG-UHFFFAOYSA-N3-[1-(ethylsulfonyl)-4-piperidinyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-7-carboxamide860625-20-3DA-244643-[1-(ethanesulfonyl)-4-piperidinyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxa-borolan-2-yl)-1H-indole-7-carboxamide3-[1-(ethanesulfonyl)-4-piperidinyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-indole-7-carboxamide

Database identifiers

PubChem CID
59828929

Properties

Computed structural properties

Topological polar surface area
123 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
32

Related reactions

45 records

Linked notes

Loading…