Compound C27H34N4O9S

2-methoxy-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]-1,3-benzothiazol-6-amine;oxalic acid

CAS: 77563-04-3

Molecular Formula	`C27H34N4O9S`
Molecular Weight	590.6 g/mol
Topological Polar Surface Area	218.0 A2
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	14
Rotatable Bonds	10
Exact Mass	590.20465
Heavy Atoms	41
Complexity	553.0

Chemical Identifiers

CAS Number	77563-04-3
SMILES	`CC(CN1CCN(CC1)CCC2=CC=CC=C2)NC3=CC4=C(C=C3)N=C(S4)OC.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O`
InChIKey	`TWHLVJARDSJMHY-UHFFFAOYSA-N`

📖 Product Overview

Compound C27H34N4O9S (CAS: 77563-04-3) is a chemical compound with molecular formula C27H34N4O9S and molecular weight 590.6 g/mol. Its IUPAC systematic name is 2-methoxy-N-[1-[4-(2-phenylethyl)piperazin-1-yl]propan-2-yl]-1,3-benzothiazol-6-amine;oxalic acid. Topological Polar Surface Area 218.0 A2 Hydrogen Bond Donors 5 Hydrogen Bond Acceptors 14 Rotatable Bonds 10 Exact Mass 590.20465 Heavy Atoms 41 Complexity 553.0 InChI Key: TWHLVJARDSJMHY-UHFFFAOYSA-N. SMILES: CC(CN1CCN(CC1)CCC2=CC=CC=C2)NC3=CC4=C(C=C3)N=C(S4)OC.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.

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