AC1LAGC5

methyl N-[(2S)-1-[2-[(2S,3S)-2-hydroxy-3-[[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]amino]-4-phenylbutyl]-2-[(4-pyridin-2-ylphenyl)methyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]carbamate

Also Known As: Heterocyclic Azahexane deriv.|J1.006.709J|2,5,6,10,13-Pentaazatetradecanedioic acid, 8-hydroxy-3,12-bis(1-methylethyl)-4,11-dioxo-9-(phenylmethyl)-6-((4-(2-pyridinyl)phenyl)methyl)-, dimethyl ester, (3S,8S,9S,12S)-|1-(4-(Pyridin-2-yl)-phenyl)-4(S)-hydroxy-5(S)-2,5-bis(N-(N-methoxycarbonyl-(L)-valyl)amino)-6-phenyl-2-azahexane|methyl{(5s,10s,11s,14s)-11-benzyl-10-hydroxy-15-methyl-3,6,13-trioxo-5-(propan-2-yl)-8-[4-(pyridin-2-yl)benzyl]-2-oxa-4,7,8,12-tetraazahexadecan-14-yl}carbamate|(2S)-N-[(2S,3S)-3-Hydroxy-4-(2-[(2S)-1-hydroxy-2-{[hydroxy(methoxy)methylidene]amino}-3-methylbutylidene]-1-{[4-(pyridin-2-yl)phenyl]methyl}hydrazin-1-yl)-1-phenylbutan-2-yl]-2-{[hydroxy(methoxy)methylidene]amino}-3-methylbutanimidic acid|{(S)-1-[N''-[(2S,3S)-2-Hydroxy-3-((S)-2-methoxycarbonylamino-3-methyl-butyrylamino)-4-phenyl-butyl]-N''-(4-pyridin-2-yl-benzyl)-hydrazinocarbonyl]-2-methyl-propyl}-carbamic acid methyl ester|1-[4-(Pyridin-2-yl)-phenyl]-4(S)-hydroxy-5(S)-2,5-bis[N-(N-methoxycarbonyl-(L)-valyl)amino]-6-phenyl-2-azahexane|2,5,6,10,13-Pentaazatetradecanedioic acid, 8-hydroxy-3,12-bis(1-methylethyl)-4,11-dioxo-9-(phenylmethyl)-6-[[4-(2-pyridinyl)phenyl]methyl]-, dimethyl ester, (3S,8S,9S,12S)-|methyl N-[(1S)-1-[[(1S,2S)-1-benzyl-2-hydroxy-3-[[[(2S)-2-(methoxycarbonylamino)-3-methyl-butanoyl]amino]-[[4-(2-pyridyl)phenyl]methyl]amino]propyl]carbamoyl]-2-methyl-propyl]carbamate|METHYL N-[(1S)-1-{N'-[(2S,3S)-2-HYDROXY-3-[(2S)-2-[(METHOXYCARBONYL)AMINO]-3-METHYLBUTANAMIDO]-4-PHENYLBUTYL]-N'-{[4-(PYRIDIN-2-YL)PHENYL]METHYL}HYDRAZINECARBONYL}-2-METHYLPROPYL]CARBAMATE|methyl N-[(2S)-1-[2-[(2S,3S)-2-hydroxy-3-[[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]amino]-4-phenylbutyl]-2-[(4-pyridin-2-ylphenyl)methyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]carbamate|N,N -[(3S,4S)-1-[4-(2-Pyridinyl)benzyl]-3-hydroxy-4-benzyl-1-azabutane-1,4-diyl]bis[Nalpha-(methoxycarbonyl)-L-valinamide]|N-{3-Hydroxy-4-[2-(1-hydroxy-2-{[hydroxy(methoxy)methylidene]amino}-3-methylbutylidene)-1-{[4-(pyridin-2-yl)phenyl]methyl}hydrazinyl]-1-phenylbutan-2-yl}-2-{[hydroxy(methoxy)methylidene]amino}-3-methylbutanimidic acid

Molecular Formula	C36H48N6O7
Molecular Weight	676.35846 g/mol
LogP	4.8
Topological Polar Surface Area	171.0 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	9
Rotatable Bonds	18
Exact Mass	676.35846
Monoisotopic Mass	676.35846
Heavy Atoms	49
Complexity	1030.0

Chemical Identifiers

CAS Number	199852-48-7
SMILES	CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](CN(CC2=CC=C(C=C2)C3=CC=CC=N3)NC(=O)[C@H](C(C)C)NC(=O)OC)O)NC(=O)OC
InChIKey	VYMKRRDHEOUFPR-YDPTYEFTSA-N