2-[4-(6-chloropyridazin-3-yl)-1,4-diazepan-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1)

Chemical Structure Depiction of
2-[4-(6-chloropyridazin-3-yl)-1,4-diazepan-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Available: 9 mg
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mg
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Compound characteristics

Compound ID: G889-1554
Compound Name: 2-[4-(6-chloropyridazin-3-yl)-1,4-diazepan-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Molecular Weight: 571.96
Molecular Formula: C21 H20 Cl N5 O3 S
Salt: CF3COOH
Smiles: C1CN(CCN(C1)c1ccc(nn1)[Cl])c1ccc(cc1C(O)=O)NC(c1cccs1)=O
Stereo: ACHIRAL
logP: 3.7073
logD: 1.4566
logSw: -4.1442
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 2
Polar surface area: 80.572
InChI Key: QDUGXVCBLOSGIU-UHFFFAOYSA-N
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