(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione

C158H244Cl2N4O30S4 — CID 161470729

About (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione

(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione (PubChem CID 161470729) has the molecular formula C158H244Cl2N4O30S4 and a molecular weight of 2878.86 g/mol. Its IUPAC name is (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione.

Molecular Properties

• Compound Name: (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione
• PubChem CID: 161470729
• Molecular Formula: C158H244Cl2N4O30S4
• Molecular Weight: 2878.86 g/mol
• Exact Mass: 2875.60
• IUPAC Name: (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione
• SMILES: C=CCCC(=O)C(=O)[C@@H](CC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](CC(=O)CC1([C@H]3CCCCS3(=O)=O)CCCCC1)C(C)(C)C)C2(C)C)CC1CC1.C=CCCC(=O)C(=O)[C@H](CCCC)CC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](CC(=O)CC1(C3COCCS3(=O)=O)CCCCC1)C(C)(C)C)C2(C)C.CCCC[C@H](CC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](CC(=O)CC1(C3CCCS3(=O)=O)CCCCC1)C(C)(C)C)C2(Cl)Cl)C(=O)C(=O)CC1CC1.CCCC[C@H](CC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](CC(=O)CC1(CS(=O)(=O)C3(C)CCOCC3)CCCCC1)C(C)(C)C)C2(C)C)C(=O)C(=O)CC1CC1
• InChI: InChI=1S/C42H67NO8S.C40H61NO7S.C39H61NO8S.C37H55Cl2NO7S/c1-8-9-13-29(37(47)34(46)22-28-14-15-28)23-33(45)36-35-32(40(35,5)6)26-43(36)38(48)31(39(2,3)4)24-30(44)25-42(16-11-10-12-17-42)27-52(49,50)41(7)18-20-51-21-19-41;1-7-8-14-31(43)36(45)27(21-26-16-17-26)22-32(44)35-34-30(39(34,5)6)25-41(35)37(46)29(38(2,3)4)23-28(42)24-40(18-11-9-12-19-40)33-15-10-13-20-49(33,47)48;1-8-10-15-26(35(44)30(42)16-11-9-2)21-31(43)34-33-29(38(33,6)7)24-40(34)36(45)28(37(3,4)5)22-27(41)23-39(17-13-12-14-18-39)32-25-48-19-20-49(32,46)47;1-5-6-11-24(33(44)29(43)18-23-13-14-23)19-28(42)32-31-27(37(31,38)39)22-40(32)34(45)26(35(2,3)4)20-25(41)21-36(15-8-7-9-16-36)30-12-10-17-48(30,46)47/h28-29,31-32,35-36H,8-27H2,1-7H3;7,26-27,29-30,33-35H,1,8-25H2,2-6H3;9,26,28-29,32-34H,2,8,10-25H2,1,3-7H3;23-24,26-27,30-32H,5-22H2,1-4H3/t29-,31-,32+,35+,36-;27-,29-,30+,33-,34+,35-;26-,28-,29+,32?,33+,34-;24-,26-,27+,30?,31+,32-/m1111/s1
• InChIKey: WDASODQPQAPLPZ-VZNKYPLKSA-N
• XLogP: 26.97
• TPSA: 509.38 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 67
• Heavy Atoms: 198
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2878.86
LogP ≤ 5	26.97
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione?

The IUPAC name of (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione (CID 161470729) is (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione.

What is the SMILES notation for (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione?

The canonical SMILES for (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione is C=CCCC(=O)C(=O)[C@@H](CC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](CC(=O)CC1([C@H]3CCCCS3(=O)=O)CCCCC1)C(C)(C)C)C2(C)C)CC1CC1.C=CCCC(=O)C(=O)[C@H](CCCC)CC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](CC(=O)CC1(C3COCCS3(=O)=O)CCCCC1)C(C)(C)C)C2(C)C.CCCC[C@H](CC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](CC(=O)CC1(C3CCCS3(=O)=O)CCCCC1)C(C)(C)C)C2(Cl)Cl)C(=O)C(=O)CC1CC1.CCCC[C@H](CC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](CC(=O)CC1(CS(=O)(=O)C3(C)CCOCC3)CCCCC1)C(C)(C)C)C2(C)C)C(=O)C(=O)CC1CC1.

What is the InChIKey of (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione?

The InChIKey is WDASODQPQAPLPZ-VZNKYPLKSA-N. The full InChI is InChI=1S/C42H67NO8S.C40H61NO7S.C39H61NO8S.C37H55Cl2NO7S/c1-8-9-13-29(37(47)34(46)22-28-14-15-28)23-33(45)36-35-32(40(35,5)6)26-43(36)38(48)31(39(2,3)4)24-30(44)25-42(16-11-10-12-17-42)27-52(49,50)41(7)18-20-51-21-19-41;1-7-8-14-31(43)36(45)27(21-26-16-17-26)22-32(44)35-34-30(39(34,5)6)25-41(35)37(46)29(38(2,3)4)23-28(42)24-40(18-11-9-12-19-40)33-15-10-13-20-49(33,47)48;1-8-10-15-26(35(44)30(42)16-11-9-2)21-31(43)34-33-29(38(33,6)7)24-40(34)36(45)28(37(3,4)5)22-27(41)23-39(17-13-12-14-18-39)32-25-48-19-20-49(32,46)47;1-5-6-11-24(33(44)29(43)18-23-13-14-23)19-28(42)32-31-27(37(31,38)39)22-40(32)34(45)26(35(2,3)4)20-25(41)21-36(15-8-7-9-16-36)30-12-10-17-48(30,46)47/h28-29,31-32,35-36H,8-27H2,1-7H3;7,26-27,29-30,33-35H,1,8-25H2,2-6H3;9,26,28-29,32-34H,2,8,10-25H2,1,3-7H3;23-24,26-27,30-32H,5-22H2,1-4H3/t29-,31-,32+,35+,36-;27-,29-,30+,33-,34+,35-;26-,28-,29+,32?,33+,34-;24-,26-,27+,30?,31+,32-/m1111/s1.

What are the key properties of (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione?

(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione has a molecular weight of 2878.86 g/mol, XLogP of 26.97, 67 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for (3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-(4,4-dioxo-1,4-oxathian-3-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]non-8-ene-1,4,5-trione;(3R)-3-butyl-1-[(1S,2S,5R)-3-[(2S)-2-tert-butyl-5-[1-(1,1-dioxothiolan-2-yl)cyclohexyl]-4-oxopentanoyl]-6,6-dichloro-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-3-butyl-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(4-methyloxan-4-yl)sulfonylmethyl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-6-cyclopropylhexane-1,4,5-trione;(3R)-1-[(1R,2S,5S)-3-[(2S)-2-tert-butyl-5-[1-[(2R)-1,1-dioxothian-2-yl]cyclohexyl]-4-oxopentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]-3-(cyclopropylmethyl)non-8-ene-1,4,5-trione is sourced from PubChem (CID 161470729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).