2-[5-(4-methoxybenzoyl)-10-methyl-4H-pyrrolo[1,2-b][1,2,5]benzotriazepin-4-yl]acetic acid
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![2-[5-(4-methoxybenzoyl)-10-methyl-4H-pyrrolo[1,2-b][1,2,5]benzotriazepin-4-yl]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/77a2b34da98a42048167289717b9aacc.png "2-[5-(4-methoxybenzoyl)-10-methyl-4H-pyrrolo[1,2-b][1,2,5]benzotriazepin-4-yl]acetic acid")
2-[5-(4-methoxybenzoyl)-10-methyl-4H-pyrrolo[1,2-b][1,2,5]benzotriazepin-4-yl]acetic acid
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CAS No:
131967-20-9
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Formula:
C22H21N3O4
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Chemical Name:
2-[5-(4-methoxybenzoyl)-10-methyl-4H-pyrrolo[1,2-b][1,2,5]benzotriazepin-4-yl]acetic acid
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Synonyms:
5-methyl-10,11-dihydro-5H-pyrrolo(1,2-b)(1,2,5)benzotriazepine-11-acetic acid;5-MPBA;NSC644253;131967-20-9;2-[5-(4-methoxybenzoyl)-10-methyl-4H-pyrrolo[1,2-b][1,2,5]benzotriazepin-4-yl]acetic acid;5-Mpba;(10-(4-Methoxybenzoyl)-5-methyl-10,11-dihydro-5H-pyrrolo[1,2-b][1,2,5]benzotriazepin-11-yl)acetic acid;[10-(4-Methoxybenzoyl)-5-methyl-10,11-dihydro-5H-pyrrolo[1,2-b][1,2,5]benzotriazepin-11-yl]acetic acid;ACMC-20muba;SCHEMBL3870427;CHEMBL1975742;DTXSID20927482;NSC-644253;5H-Pyrrolo[1,2-b][1,2,5]benzotriazepine-11-aceticacid, 10,11-dihydro-10-(4-methoxybenzoyl)-5-methyl-;NCI60_014998;5H-Pyrrolo(1,2-b)(1,2,5)benzotriazepine-11-acetic acid, 10,11-dihydro-10-(4-methoxybenzoyl)-5-methyl-
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CAS No:
2-[5-(4-methoxybenzoyl)-10-methyl-4H-pyrrolo[1,2-b][1,2,5]benzotriazepin-4-yl]acetic acid Basic Attributes
391.4 g/mol
391.15320616 g/mol
644253
Computed Properties
Molecular Weight:391.4
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:391.15320616
Monoisotopic Mass:391.15320616
Topological Polar Surface Area:75
Heavy Atom Count:29
Complexity:607
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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