2-[5-[[2-[[bis(pyridin-2-ylmethyl)amino]methyl]anilino]methyl]-2-chloro-6-hydroxy-3-oxoxanthen-9-yl]benzoic acid
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![2-[5-[[2-[[bis(pyridin-2-ylmethyl)amino]methyl]anilino]methyl]-2-chloro-6-hydroxy-3-oxoxanthen-9-yl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/39ea9a9fd5e94227816e5a427c4d3666.png "2-[5-[[2-[[bis(pyridin-2-ylmethyl)amino]methyl]anilino]methyl]-2-chloro-6-hydroxy-3-oxoxanthen-9-yl]benzoic acid")
2-[5-[[2-[[bis(pyridin-2-ylmethyl)amino]methyl]anilino]methyl]-2-chloro-6-hydroxy-3-oxoxanthen-9-yl]benzoic acid
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CAS No:
502467-23-4
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Formula:
C40H31ClN4O5
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Chemical Name:
2-[5-[[2-[[bis(pyridin-2-ylmethyl)amino]methyl]anilino]methyl]-2-chloro-6-hydroxy-3-oxoxanthen-9-yl]benzoic acid
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Synonyms:
ZP 4; Zinpyr-4; 5'-[[[2-[[bis(2-pyridinylmethyl)amino]methyl]phenyl]amino]methyl]-2'-chloro-3',6'-dihydroxy-spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one; 9-(o-Carboxyphenyl)-2-chloro-5-[2-{bis(2-pyridylmethyl)aminomethyl}-N-methylaniline]-6-hydroxy-3-xanthanone;
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CAS No:
2-[5-[[2-[[bis(pyridin-2-ylmethyl)amino]methyl]anilino]methyl]-2-chloro-6-hydroxy-3-oxoxanthen-9-yl]benzoic acid Basic Attributes
683.15100
682.1982978
DTXSID90408137
Computed Properties
Molecular Weight:683.1
XLogP3:3.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:11
Exact Mass:682.1982978
Monoisotopic Mass:682.1982978
Topological Polar Surface Area:125
Heavy Atom Count:50
Complexity:1300
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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