tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate

C153H183Cl7N16O45S7 — CID 160665516

About tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate

tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate (PubChem CID 160665516) has the molecular formula C153H183Cl7N16O45S7 and a molecular weight of 3438.85 g/mol. Its IUPAC name is tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate.

Molecular Properties

• Compound Name: tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate
• PubChem CID: 160665516
• Molecular Formula: C153H183Cl7N16O45S7
• Molecular Weight: 3438.85 g/mol
• Exact Mass: 3432.84
• IUPAC Name: tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate
• SMILES: CC(C)(C)OC(=O)N1CCC[C@H](S(=O)(=O)c2c(Cl)ccc(NC(=O)N[C@@H]3CCCc4ccoc43)c2O)C1.CC(C)(C)OC(=O)N1CCC[C@H](S(=O)(=O)c2c(Cl)ccc(NC(=O)N[C@H]3CCCc4ccoc43)c2O)C1.CC(C)(C)S(=O)(=O)c1c(Cl)ccc(NC(=O)N[C@H]2CCCc3ccoc32)c1O.COC(=O)CCCS(=O)(=O)c1c(Cl)ccc(NC(=O)N[C@@H]2CCCc3ccoc32)c1O.COC(=O)CCCS(=O)(=O)c1c(Cl)ccc(NC(=O)N[C@H]2CCCc3ccoc32)c1O.O=C(Nc1ccc(Cl)c(S(=O)(=O)CCCC(=O)C2CC2)c1O)N[C@@H]1CCCc2ccoc21.O=C(Nc1ccc(Cl)c(S(=O)(=O)CCCC(=O)C2CC2)c1O)N[C@H]1CCCc2ccoc21
• InChI: InChI=1S/2C25H32ClN3O7S.2C22H25ClN2O6S.2C20H23ClN2O7S.C19H23ClN2O5S/c2*1-25(2,3)36-24(32)29-12-5-7-16(14-29)37(33,34)22-17(26)9-10-18(20(22)30)27-23(31)28-19-8-4-6-15-11-13-35-21(15)19;2*23-15-8-9-16(24-22(28)25-17-4-1-3-14-10-11-31-20(14)17)19(27)21(15)32(29,30)12-2-5-18(26)13-6-7-13;2*1-29-16(24)6-3-11-31(27,28)19-13(21)7-8-14(17(19)25)22-20(26)23-15-5-2-4-12-9-10-30-18(12)15;1-19(2,3)28(25,26)17-12(20)7-8-13(15(17)23)21-18(24)22-14-6-4-5-11-9-10-27-16(11)14/h2*9-11,13,16,19,30H,4-8,12,14H2,1-3H3,(H2,27,28,31);2*8-11,13,17,27H,1-7,12H2,(H2,24,25,28);2*7-10,15,25H,2-6,11H2,1H3,(H2,22,23,26);7-10,14,23H,4-6H2,1-3H3,(H2,21,22,24)/t16-,19+;16-,19-;2*17-;2*15-;14-/m0010100/s1
• InChIKey: RMFZJNQVVCNHIA-JXUXHQBLSA-N
• XLogP: 30.30
• TPSA: 906.30 Ų
• H-Bond Donors: 21
• H-Bond Acceptors: 45
• Rotatable Bonds: 41
• Heavy Atoms: 228
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3438.85
LogP ≤ 5	30.30
H-Bond Donors ≤ 5	21
H-Bond Acceptors ≤ 10	45

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate?

The IUPAC name of tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate (CID 160665516) is tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate.

What is the SMILES notation for tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate?

The canonical SMILES for tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate is CC(C)(C)OC(=O)N1CCC[C@H](S(=O)(=O)c2c(Cl)ccc(NC(=O)N[C@@H]3CCCc4ccoc43)c2O)C1.CC(C)(C)OC(=O)N1CCC[C@H](S(=O)(=O)c2c(Cl)ccc(NC(=O)N[C@H]3CCCc4ccoc43)c2O)C1.CC(C)(C)S(=O)(=O)c1c(Cl)ccc(NC(=O)N[C@H]2CCCc3ccoc32)c1O.COC(=O)CCCS(=O)(=O)c1c(Cl)ccc(NC(=O)N[C@@H]2CCCc3ccoc32)c1O.COC(=O)CCCS(=O)(=O)c1c(Cl)ccc(NC(=O)N[C@H]2CCCc3ccoc32)c1O.O=C(Nc1ccc(Cl)c(S(=O)(=O)CCCC(=O)C2CC2)c1O)N[C@@H]1CCCc2ccoc21.O=C(Nc1ccc(Cl)c(S(=O)(=O)CCCC(=O)C2CC2)c1O)N[C@H]1CCCc2ccoc21.

What is the InChIKey of tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate?

The InChIKey is RMFZJNQVVCNHIA-JXUXHQBLSA-N. The full InChI is InChI=1S/2C25H32ClN3O7S.2C22H25ClN2O6S.2C20H23ClN2O7S.C19H23ClN2O5S/c2*1-25(2,3)36-24(32)29-12-5-7-16(14-29)37(33,34)22-17(26)9-10-18(20(22)30)27-23(31)28-19-8-4-6-15-11-13-35-21(15)19;2*23-15-8-9-16(24-22(28)25-17-4-1-3-14-10-11-31-20(14)17)19(27)21(15)32(29,30)12-2-5-18(26)13-6-7-13;2*1-29-16(24)6-3-11-31(27,28)19-13(21)7-8-14(17(19)25)22-20(26)23-15-5-2-4-12-9-10-30-18(12)15;1-19(2,3)28(25,26)17-12(20)7-8-13(15(17)23)21-18(24)22-14-6-4-5-11-9-10-27-16(11)14/h2*9-11,13,16,19,30H,4-8,12,14H2,1-3H3,(H2,27,28,31);2*8-11,13,17,27H,1-7,12H2,(H2,24,25,28);2*7-10,15,25H,2-6,11H2,1H3,(H2,22,23,26);7-10,14,23H,4-6H2,1-3H3,(H2,21,22,24)/t16-,19+;16-,19-;2*17-;2*15-;14-/m0010100/s1.

What are the key properties of tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate?

tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate has a molecular weight of 3438.85 g/mol, XLogP of 30.30, 41 rotatable bonds, 21 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;tert-butyl (3S)-3-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylpiperidine-1-carboxylate;1-(3-tert-butylsulfonyl-4-chloro-2-hydroxyphenyl)-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;1-[4-chloro-3-(4-cyclopropyl-4-oxobutyl)sulfonyl-2-hydroxyphenyl]-3-[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]urea;methyl 4-[6-chloro-2-hydroxy-3-[[(7S)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate;methyl 4-[6-chloro-2-hydroxy-3-[[(7R)-4,5,6,7-tetrahydro-1-benzofuran-7-yl]carbamoylamino]phenyl]sulfonylbutanoate is sourced from PubChem (CID 160665516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).