tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen

C105H165N5O19 — CID 159047761

IUPACtert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen
SMILESC=CC(C)(C)[C@@H]1OC(=O)N[C@]1(C)C(C)(C)c1ccc(OC(C)(C)C)cc1.C=CC(C)(C)[C@H]1OC(=O)N[C@]1(C)C(C)(C)c1ccc(OC(C)(C)C)cc1.C=CC[C@@H](O)[C@@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C.C=CC[C@H](O)[C@@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C.COC(=O)[C@@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C.[H][H].[H][H]
InChIInChI=1S/2C22H33NO3.2C21H33NO4.C19H29NO5.2H2/c2*1-10-20(5,6)17-22(9,23-18(24)25-17)21(7,8)15-11-13-16(14-12-15)26-19(2,3)4;2*1-8-9-18(23)17(22-19(24)26-21(5,6)7)14-15-10-12-16(13-11-15)25-20(2,3)4;1-18(2,3)24-14-10-8-13(9-11-14)12-15(16(21)23-7)20-17(22)25-19(4,5)6;;/h2*10-14,17H,1H2,2-9H3,(H,23,24);2*8,10-13,17-18,23H,1,9,14H2,2-7H3,(H,22,24);8-11,15H,12H2,1-7H3,(H,20,22);2*1H/t17-,22+;17-,22-;17-,18+;17-,18-;15-;;/m10111../s1
InChIKeyJWWHCVAOYZIBFE-CGLWJXGCSA-N
MW1801.49 g/mol
LogP22.88
Rot. Bonds29

About tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen

tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen (PubChem CID 159047761) has the molecular formula C105H165N5O19 and a molecular weight of 1801.49 g/mol. Its IUPAC name is tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen.

Molecular Properties

Compound Nametert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen
PubChem CID159047761
Molecular FormulaC105H165N5O19
Molecular Weight1801.49 g/mol
Exact Mass1800.21
IUPAC Nametert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen
SMILESC=CC(C)(C)[C@@H]1OC(=O)N[C@]1(C)C(C)(C)c1ccc(OC(C)(C)C)cc1.C=CC(C)(C)[C@H]1OC(=O)N[C@]1(C)C(C)(C)c1ccc(OC(C)(C)C)cc1.C=CC[C@@H](O)[C@@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C.C=CC[C@H](O)[C@@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C.COC(=O)[C@@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C.[H][H].[H][H]
InChIInChI=1S/2C22H33NO3.2C21H33NO4.C19H29NO5.2H2/c2*1-10-20(5,6)17-22(9,23-18(24)25-17)21(7,8)15-11-13-16(14-12-15)26-19(2,3)4;2*1-8-9-18(23)17(22-19(24)26-21(5,6)7)14-15-10-12-16(13-11-15)25-20(2,3)4;1-18(2,3)24-14-10-8-13(9-11-14)12-15(16(21)23-7)20-17(22)25-19(4,5)6;;/h2*10-14,17H,1H2,2-9H3,(H,23,24);2*8,10-13,17-18,23H,1,9,14H2,2-7H3,(H,22,24);8-11,15H,12H2,1-7H3,(H,20,22);2*1H/t17-,22+;17-,22-;17-,18+;17-,18-;15-;;/m10111../s1
InChIKeyJWWHCVAOYZIBFE-CGLWJXGCSA-N
XLogP22.88
TPSA304.56 Ų
H-Bond Donors7
H-Bond Acceptors19
Rotatable Bonds29
Heavy Atoms129
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001801.49
LogP ≤ 522.88
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen with MolForge

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Launch Full Analysis

Related Compounds

methyl (8S,11S,14S)-11-[(2S)-butan-2-yl]-14-[[(2S,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenylbutyl]amino]-10,13-dioxo-2-oxa-9,12-diazatricyclo[14.2.2.23,6]docosa-1(18),3(22),4,6(21),16,19-hexaene-8-carboxylate
CID 71462948
(2S)-2-[[(2S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(4-phenylphenoxy)pyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid
CID 127034736
[1-((1R,2R)-2-Hydroxy-1-hydroxymethyl-2-phenyl-ethylcarbamoyl)-1-methyl-2-(4-phenoxy-phenyl)-ethyl]-carbamic acid adamantan-2-yl ester
CID 44303299
Z-Tyr(tBu)-OH.DCHA
CID 14162127
lithium;3-[3-[4,4-dimethyl-2-[[(4S,5R)-4-methyl-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-oxo-1,3-oxazolidin-3-yl]methyl]cyclohexen-1-yl]-4-methoxyphenyl]-2,2-dimethylpropanoic acid;methyl 3-[3-[4,4-dimethyl-2-[[(4S,5R)-4-methyl-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-oxo-1,3-oxazolidin-3-yl]methyl]cyclohexen-1-yl]-4-methoxyphenyl]-2,2-dimethylpropanoate;methyl 3-[3-[2-[[[(1R,2S)-1-hydroxy-1-[3-methyl-5-(trifluoromethyl)phenyl]propan-2-yl]amino]methyl]-4,4-dimethylcyclohexen-1-yl]-4-methoxyphenyl]-2,2-dimethylpropanoate;hydroxide
CID 159152981
z-d-Tyr(tbu)-oh.dcha
CID 53229926
N-benzyloxycarbonyl-O-benzyltyrosylglycylglycylphenylalanylleucine
CID 14629436
(S)-4-((R)-2-(((3R,4S,7S,10S)-10-(4-(tert-Butoxy)benzyl)-3-methyl-5,8,11-trioxo-7-(2-oxo-2-(tritylamino)ethyl)-1-phenyl-2-oxa-6,9,12-triazahexadecan-4-yl)carbamoyl)pyrrolidin-1-yl)-3-((tert-butoxycarbonyl)amino)-4-oxobutanoic acid
CID 60182345
(3R,4S,7S,10S)-10-(4-(tert-Butoxy)benzyl)-4-((R)-1-((S)-2-((tert-butoxycarbonyl)amino)-3-carboxypropanoyl)pyrrolidine-2-carboxamido)-3-methyl-5,8,11-trioxo-7-(2-oxo-2-(tritylamino)ethyl)-1-phenyl-2-oxa-6,9,12-triazatetradecan-14-oic acid
CID 60182347
(S)-4-((R)-2-(((4S,7S,10S,11R)-4-(4-(tert-Butoxy)benzyl)-11-methyl-3,6,9-trioxo-7-(2-oxo-2-(tritylamino)ethyl)-13-phenyl-2,12-dioxa-5,8-diazatridecan-10-yl)carbamoyl)pyrrolidin-1-yl)-3-((tert-butoxycarbonyl)amino)-4-oxobutanoic acid
CID 60182348
Boc-Ser(Bzl)-Gly-Tyr(Bzl)-Ser(Bzl)-Gly-Lys(Z)
CID 101802398
O-benzyl-l-tyrosyl-l-prolyl-N-benzyloxycarbonyl-l-lysyl-O-benzyl-l-threonine benzyl ester
CID 129777375

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen?
The IUPAC name of tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen (CID 159047761) is tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen.
What is the SMILES notation for tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen?
The canonical SMILES for tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen is C=CC(C)(C)[C@@H]1OC(=O)N[C@]1(C)C(C)(C)c1ccc(OC(C)(C)C)cc1.C=CC(C)(C)[C@H]1OC(=O)N[C@]1(C)C(C)(C)c1ccc(OC(C)(C)C)cc1.C=CC[C@@H](O)[C@@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C.C=CC[C@H](O)[C@@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C.COC(=O)[C@@H](Cc1ccc(OC(C)(C)C)cc1)NC(=O)OC(C)(C)C.[H][H].[H][H].
What is the InChIKey of tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen?
The InChIKey is JWWHCVAOYZIBFE-CGLWJXGCSA-N. The full InChI is InChI=1S/2C22H33NO3.2C21H33NO4.C19H29NO5.2H2/c2*1-10-20(5,6)17-22(9,23-18(24)25-17)21(7,8)15-11-13-16(14-12-15)26-19(2,3)4;2*1-8-9-18(23)17(22-19(24)26-21(5,6)7)14-15-10-12-16(13-11-15)25-20(2,3)4;1-18(2,3)24-14-10-8-13(9-11-14)12-15(16(21)23-7)20-17(22)25-19(4,5)6;;/h2*10-14,17H,1H2,2-9H3,(H,23,24);2*8,10-13,17-18,23H,1,9,14H2,2-7H3,(H,22,24);8-11,15H,12H2,1-7H3,(H,20,22);2*1H/t17-,22+;17-,22-;17-,18+;17-,18-;15-;;/m10111../s1.
What are the key properties of tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen?
tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen has a molecular weight of 1801.49 g/mol, XLogP of 22.88, 29 rotatable bonds, 7 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(2R,3R)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;tert-butyl N-[(2R,3S)-3-hydroxy-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]hex-5-en-2-yl]carbamate;(4R,5R)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;(4R,5S)-4-methyl-5-(2-methylbut-3-en-2-yl)-4-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]-1,3-oxazolidin-2-one;methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate;molecular hydrogen is sourced from PubChem (CID 159047761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).