Molecules/1-acetyl-2,3-dihydro-1H-indole-5-sulfonic acid ethylamino-(4-ethyl-4,5-dihydro-pyrazol-1-yl)-methyleneamide
1-acetyl-2,3-dihydro-1H-indole-5-sulfonic acid ethylamino-(4-ethyl-4,5-dihydro-pyrazol-1-yl)-methyleneamide
N-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonyl]-N',4-diethyl-3,4-dihydropyrazole-2-carboximidamide
Molecular Identity
1-acetyl-2,3-dihydro-1H-indole-5-sulfonic acid ethylamino-(4-ethyl-4,5-dihydro-pyrazol-1-yl)-methyleneamide
N-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonyl]-N',4-diethyl-3,4-dihydropyrazole-2-carboximidamide
PubChem CID: 24855751
2D Structure
Properties
C18H25N5O3S
Molecular Formula
391.50
Molecular Weight
g/mol
391.1678
Exact Mass
Da
1
XLogP
Drug-like (Lipinski: < 5)
103
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
715
Complexity
SMILES
Canonical SMILES
SMILES: CCC1CN(N=C1)C(=NCC)NS(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(=O)CIsomeric SMILES
SMILES: CCC1CN(N=C1)C(=NCC)NS(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(=O)CSynonyms(7)
SCHEMBL1179636SCHEMBL1179637SCHEMBL8000302SCHEMBL26599068ABT-354OOZDUCWFFHOFDS-UHFFFAOYSA-N1-acetyl-2,3-dihydro-1H-indole-5-sulfonic acid ethylamino-(4-ethyl-4,5-dihydro-pyrazol-1-yl)-methyleneamide
Data from PubChem (NCBI)
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Molecular Structure
1-acetyl-2,3-dihydro-1H-indole-5-sulfonic acid ethylamino-(4-ethyl-4,5-dihydro-pyrazol-1-yl)-methyleneamide
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Drug Network
Trials and conditions connected to 1-acetyl-2,3-dihydro-1H-indole-5-sulfonic acid ethylamino-(4-ethyl-4,5-dihydro-pyrazol-1-yl)-methyleneamide
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