rac-3-[(4-(2-(Hydroxymethyl)piperazin-1-yl)-1,3,5-triazin-2-yl)amino]benzenemethanesulfonamide

HCID 60197201
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Basic information

Standard SMILES
NS(=O)(=O)Cc1cccc(Nc2ncnc(N3CCNCC3CO)n2)c1
InChIKey
FMAVREGRADXIAP-UHFFFAOYSA-N
Molecular formula
C15H21N7O3S
Average molar mass
379.4 g/mol

Names & identifiers

Preferred name
rac-3-[(4-(2-(Hydroxymethyl)piperazin-1-yl)-1,3,5-triazin-2-yl)amino]benzenemethanesulfonamide
IUPAC
[3-[[4-[2-(hydroxymethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]phenyl]methanesulfonamide

Names & synonyms

SCHEMBL12487046FMAVREGRADXIAP-UHFFFAOYSA-Nrac-3-[(4-(2-(Hydroxymethyl)piperazin-1-yl)-1,3,5-triazin-2-yl)amino]benzenemethanesulfonamide

Database identifiers

PubChem CID
60197201

Properties

Computed structural properties

XLogP
-0.5
Topological polar surface area
155 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
10
Rotatable bonds
6
Heavy atoms
26

Related reactions

1 records
New reaction record

Compound notes

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rac-3-[(4-(2-(Hydroxymethyl)piperazin-1-yl)-1,3,5-triazin-2-yl)amino]benzenemethanesulfonamide (HCID 60197201)｜Huagongshe