(Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol

C138H214Cl4FNO10S5 — CID 159512483

IUPAC(Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol
SMILESCCC1(C(O)C/C=C/[C@@H]2[C@@H](C/C=C\CCCC(C)=O)[C@H](Cl)C[C@H]2O)CCC1.CCC1(C(O)C/C=C/[C@@H]2[C@@H](CCCc3ccc(C)s3)CC[C@H]2Cl)CCC1.CCC1(C(O)C/C=C/[C@@H]2[C@@H](CCCc3ccc(C)s3)[C@H](Cl)C[C@H]2O)CCC1.CCC1(C(O)CCC[C@@H]2[C@@H](CCCc3ccc(C)s3)CC[C@H]2F)CCC1.CCCCCCCC[C@@H]1[C@@H](CCCc2ccc(C(C)=O)s2)[C@H](Cl)C[C@H]1O.[C-]#[N+][C@@H]1CC[C@H](CCCc2ccc(C)s2)[C@H]1/C=C/CC(O)C1(CC)CCC1
InChIInChI=1S/C24H35NOS.C23H37ClO3.C23H35ClO2S.C23H35ClOS.C23H37FOS.C22H35ClO2S/c1-4-24(16-7-17-24)23(26)11-6-10-21-19(13-15-22(21)25-3)8-5-9-20-14-12-18(2)27-20;1-3-23(14-9-15-23)22(27)13-8-12-19-18(20(24)16-21(19)26)11-7-5-4-6-10-17(2)25;1-3-23(13-6-14-23)22(26)10-5-9-19-18(20(24)15-21(19)25)8-4-7-17-12-11-16(2)27-17;2*1-3-23(15-6-16-23)22(25)10-5-9-20-18(12-14-21(20)24)7-4-8-19-13-11-17(2)26-19;1-3-4-5-6-7-8-11-19-18(20(23)15-21(19)25)12-9-10-17-13-14-22(26-17)16(2)24/h6,10,12,14,19,21-23,26H,4-5,7-9,11,13,15-17H2,1-2H3;5,7-8,12,18-22,26-27H,3-4,6,9-11,13-16H2,1-2H3;5,9,11-12,18-22,25-26H,3-4,6-8,10,13-15H2,1-2H3;5,9,11,13,18,20-22,25H,3-4,6-8,10,12,14-16H2,1-2H3;11,13,18,20-22,25H,3-10,12,14-16H2,1-2H3;13-14,18-21,25H,3-12,15H2,1-2H3/b10-6+;7-5-,12-8+;2*9-5+;;/t19-,21+,22+,23?;2*18-,19-,20-,21-,22?;2*18-,20+,21+,22?;18-,19-,20-,21-/m011001/s1
InChIKeyMATUQSPGACHFFH-IEBQPACRSA-N
MW2368.37 g/mol
LogP38.02
Rot. Bonds60

About (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol

(Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol (PubChem CID 159512483) has the molecular formula C138H214Cl4FNO10S5 and a molecular weight of 2368.37 g/mol. Its IUPAC name is (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol.

Molecular Properties

Compound Name(Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol
PubChem CID159512483
Molecular FormulaC138H214Cl4FNO10S5
Molecular Weight2368.37 g/mol
Exact Mass2364.36
IUPAC Name(Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol
SMILESCCC1(C(O)C/C=C/[C@@H]2[C@@H](C/C=C\CCCC(C)=O)[C@H](Cl)C[C@H]2O)CCC1.CCC1(C(O)C/C=C/[C@@H]2[C@@H](CCCc3ccc(C)s3)CC[C@H]2Cl)CCC1.CCC1(C(O)C/C=C/[C@@H]2[C@@H](CCCc3ccc(C)s3)[C@H](Cl)C[C@H]2O)CCC1.CCC1(C(O)CCC[C@@H]2[C@@H](CCCc3ccc(C)s3)CC[C@H]2F)CCC1.CCCCCCCC[C@@H]1[C@@H](CCCc2ccc(C(C)=O)s2)[C@H](Cl)C[C@H]1O.[C-]#[N+][C@@H]1CC[C@H](CCCc2ccc(C)s2)[C@H]1/C=C/CC(O)C1(CC)CCC1
InChIInChI=1S/C24H35NOS.C23H37ClO3.C23H35ClO2S.C23H35ClOS.C23H37FOS.C22H35ClO2S/c1-4-24(16-7-17-24)23(26)11-6-10-21-19(13-15-22(21)25-3)8-5-9-20-14-12-18(2)27-20;1-3-23(14-9-15-23)22(27)13-8-12-19-18(20(24)16-21(19)26)11-7-5-4-6-10-17(2)25;1-3-23(13-6-14-23)22(26)10-5-9-19-18(20(24)15-21(19)25)8-4-7-17-12-11-16(2)27-17;2*1-3-23(15-6-16-23)22(25)10-5-9-20-18(12-14-21(20)24)7-4-8-19-13-11-17(2)26-19;1-3-4-5-6-7-8-11-19-18(20(23)15-21(19)25)12-9-10-17-13-14-22(26-17)16(2)24/h6,10,12,14,19,21-23,26H,4-5,7-9,11,13,15-17H2,1-2H3;5,7-8,12,18-22,26-27H,3-4,6,9-11,13-16H2,1-2H3;5,9,11-12,18-22,25-26H,3-4,6-8,10,13-15H2,1-2H3;5,9,11,13,18,20-22,25H,3-4,6-8,10,12,14-16H2,1-2H3;11,13,18,20-22,25H,3-10,12,14-16H2,1-2H3;13-14,18-21,25H,3-12,15H2,1-2H3/b10-6+;7-5-,12-8+;2*9-5+;;/t19-,21+,22+,23?;2*18-,19-,20-,21-,22?;2*18-,20+,21+,22?;18-,19-,20-,21-/m011001/s1
InChIKeyMATUQSPGACHFFH-IEBQPACRSA-N
XLogP38.02
TPSA200.34 Ų
H-Bond Donors8
H-Bond Acceptors15
Rotatable Bonds60
Heavy Atoms159
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002368.37
LogP ≤ 538.02
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol?
The IUPAC name of (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol (CID 159512483) is (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol.
What is the SMILES notation for (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol?
The canonical SMILES for (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol is CCC1(C(O)C/C=C/[C@@H]2[C@@H](C/C=C\CCCC(C)=O)[C@H](Cl)C[C@H]2O)CCC1.CCC1(C(O)C/C=C/[C@@H]2[C@@H](CCCc3ccc(C)s3)CC[C@H]2Cl)CCC1.CCC1(C(O)C/C=C/[C@@H]2[C@@H](CCCc3ccc(C)s3)[C@H](Cl)C[C@H]2O)CCC1.CCC1(C(O)CCC[C@@H]2[C@@H](CCCc3ccc(C)s3)CC[C@H]2F)CCC1.CCCCCCCC[C@@H]1[C@@H](CCCc2ccc(C(C)=O)s2)[C@H](Cl)C[C@H]1O.[C-]#[N+][C@@H]1CC[C@H](CCCc2ccc(C)s2)[C@H]1/C=C/CC(O)C1(CC)CCC1.
What is the InChIKey of (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol?
The InChIKey is MATUQSPGACHFFH-IEBQPACRSA-N. The full InChI is InChI=1S/C24H35NOS.C23H37ClO3.C23H35ClO2S.C23H35ClOS.C23H37FOS.C22H35ClO2S/c1-4-24(16-7-17-24)23(26)11-6-10-21-19(13-15-22(21)25-3)8-5-9-20-14-12-18(2)27-20;1-3-23(14-9-15-23)22(27)13-8-12-19-18(20(24)16-21(19)26)11-7-5-4-6-10-17(2)25;1-3-23(13-6-14-23)22(26)10-5-9-19-18(20(24)15-21(19)25)8-4-7-17-12-11-16(2)27-17;2*1-3-23(15-6-16-23)22(25)10-5-9-20-18(12-14-21(20)24)7-4-8-19-13-11-17(2)26-19;1-3-4-5-6-7-8-11-19-18(20(23)15-21(19)25)12-9-10-17-13-14-22(26-17)16(2)24/h6,10,12,14,19,21-23,26H,4-5,7-9,11,13,15-17H2,1-2H3;5,7-8,12,18-22,26-27H,3-4,6,9-11,13-16H2,1-2H3;5,9,11-12,18-22,25-26H,3-4,6-8,10,13-15H2,1-2H3;5,9,11,13,18,20-22,25H,3-4,6-8,10,12,14-16H2,1-2H3;11,13,18,20-22,25H,3-10,12,14-16H2,1-2H3;13-14,18-21,25H,3-12,15H2,1-2H3/b10-6+;7-5-,12-8+;2*9-5+;;/t19-,21+,22+,23?;2*18-,19-,20-,21-,22?;2*18-,20+,21+,22?;18-,19-,20-,21-/m011001/s1.
What are the key properties of (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol?
(Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol has a molecular weight of 2368.37 g/mol, XLogP of 38.02, 60 rotatable bonds, 8 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-8-[(1R,2R,3R,5R)-5-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-hydroxycyclopentyl]oct-6-en-2-one;(1R,2R,3R,4R)-4-chloro-2-[(E)-4-(1-ethylcyclobutyl)-4-hydroxybut-1-enyl]-3-[3-(5-methylthiophen-2-yl)propyl]cyclopentan-1-ol;1-[5-[3-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-octylcyclopentyl]propyl]thiophen-2-yl]ethanone;(E)-4-[(1S,2R,5S)-2-chloro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]-1-(1-ethylcyclobutyl)but-3-en-1-ol;1-(1-ethylcyclobutyl)-4-[(1R,2R,5S)-2-fluoro-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]butan-1-ol;(E)-1-(1-ethylcyclobutyl)-4-[(1S,2R,5S)-2-isocyano-5-[3-(5-methylthiophen-2-yl)propyl]cyclopentyl]but-3-en-1-ol is sourced from PubChem (CID 159512483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).