2,5,10,13-Tetraazatetradecanedioic acid, 7,7-difluoro-3,12-bis(1-methylethyl)-4,8,11-trioxo-6,9-bis(phenylmethyl)-, bis((6-methyl-2-pyridinyl)methyl) ester, (3S-(3R*,6R*,9R*,12R*))-
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2,5,10,13-Tetraazatetradecanedioic acid, 7,7-difluoro-3,12-bis(1-methylethyl)-4,8,11-trioxo-6,9-bis(phenylmethyl)-, bis((6-methyl-2-pyridinyl)methyl) ester, (3S-(3R*,6R*,9R*,12R*))-
structure -
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CAS No:
144163-15-5
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Formula:
C44H52F2N6O7
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Chemical Name:
2,5,10,13-Tetraazatetradecanedioic acid, 7,7-difluoro-3,12-bis(1-methylethyl)-4,8,11-trioxo-6,9-bis(phenylmethyl)-, bis((6-methyl-2-pyridinyl)methyl) ester, (3S-(3R*,6R*,9R*,12R*))-
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Synonyms:
144163-15-5;2,5,10,13-Tetraazatetradecanedioic acid, 7,7-difluoro-3,12-bis(1-methylethyl)-4,8,11-trioxo-6,9-bis(phenylmethyl)-, bis((6-methyl-2-pyridinyl)methyl) ester, (3S-(3R*,6R*,9R*,12R*))-;2,5,10,13-Tetraazatetradecanedioic acid, 7,7-difluoro-3,12-bis(1-methylethyl)-4,8,11-trioxo-6,9-bis(phenylmethyl)-, bis[(6-methyl-2-pyridinyl)methyl] ester, [3S-(3R*,6R*,9R*,12R*)]-;DTXSID80162630;(6-methyl-2-pyridyl)methyl N-[(1S)-1-[[(1S,4S)-1-benzyl-2,2-difluoro-4-[[(2S)-3-methyl-2-[(6-methyl-2-pyridyl)methoxycarbonylamino]butanoyl]amino]-3-oxo-5-phenyl-pentyl]carbamoyl]-2-methyl-propyl]carbamate
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CAS No:
2,5,10,13-Tetraazatetradecanedioic acid, 7,7-difluoro-3,12-bis(1-methylethyl)-4,8,11-trioxo-6,9-bis(phenylmethyl)-, bis((6-methyl-2-pyridinyl)methyl) ester, (3S-(3R*,6R*,9R*,12R*))- Basic Attributes
814.9 g/mol
814.38655434 g/mol
DTXSID80162630
Computed Properties
Molecular Weight:814.9
XLogP3:7.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:21
Exact Mass:814.38655434
Monoisotopic Mass:814.38655434
Topological Polar Surface Area:178
Heavy Atom Count:59
Complexity:1360
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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