1-benzofuran-2-ylmethyl N-[(2S)-1-[benzyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
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![1-benzofuran-2-ylmethyl N-[(2S)-1-[benzyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/72825428f42f457993f32c2908ad805e.png "1-benzofuran-2-ylmethyl N-[(2S)-1-[benzyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate")
1-benzofuran-2-ylmethyl N-[(2S)-1-[benzyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
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CAS No:
183023-29-2
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Formula:
C29H27N3O4
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Chemical Name:
1-benzofuran-2-ylmethyl N-[(2S)-1-[benzyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
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Synonyms:
(1-(1H-indol-3-ylmethyl)-2-(methyl(phenylmethyl)amino)-2-oxoethyl)carbamic acid 2-benzofuranylmethyl ester;CAM 4515;CAM-4515;CAM 4515;183023-29-2;DTXSID70171377;CAM-4515;Carbamic acid, ((1S)-1-(1H-indol-3-ylmethyl)-2-(methyl(phenylmethyl)amino)-2-oxoethyl)-, 2-benzofuranylmethyl ester;Carbamic acid, (1-(1H-indol-3-ylmethyl)-2-(methyl(phenylmethyl)amino)-2-oxoethyl)-, 2-benzofuranylmethyl ester, (S)-
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CAS No:
1-benzofuran-2-ylmethyl N-[(2S)-1-[benzyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate Basic Attributes
481.5 g/mol
481.20015635 g/mol
DTXSID70171377
Drug Information
Compounds that inhibit or block the activity of NEUROKININ-1 RECEPTORS. (See all compounds classified as Neurokinin-1 Receptor Antagonists.)
(1-(1H-indol-3-ylmethyl)-2-(methyl(phenylmethyl)amino)-2-oxoethyl)carbamic acid 2-benzofuranylmethyl ester
Computed Properties
Molecular Weight:481.5
XLogP3:5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:481.20015635
Monoisotopic Mass:481.20015635
Topological Polar Surface Area:87.6
Heavy Atom Count:36
Complexity:742
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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