[5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione

C256H316BrCl10N15O28 — CID 167532352

IUPAC[5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione
SMILESCC(CCCCN)c1ccc(Cl)c(CO)c1.CC(CCCCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)c(C=O)c1.CC(CCCCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)c(CO)c1.CC(CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(CBr)c1.CC(CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(CO)c1.CC(CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCN)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCN)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1
InChIInChI=1S/3C35H43ClN2O4.2C30H35ClN2O2.C21H22ClNO3.C21H20ClNO3.C18H27BrClNO2.C18H28ClNO3.C13H20ClNO/c3*1-24(9-7-8-19-38-33(39)42-34(2,3)4)25-12-15-31(36)26(21-25)23-40-35(17-18-35)30-22-37-20-16-28(30)29-10-5-6-11-32(29)41-27-13-14-27;2*1-21(6-4-5-16-32)22-9-12-28(31)23(18-22)20-34-30(14-15-30)27-19-33-17-13-25(27)26-7-2-3-8-29(26)35-24-10-11-24;2*1-14(15-9-10-19(22)16(12-15)13-24)6-4-5-11-23-20(25)17-7-2-3-8-18(17)21(23)26;1-13(14-8-9-16(20)15(11-14)12-19)7-5-6-10-21-17(22)23-18(2,3)4;1-13(14-8-9-16(19)15(11-14)12-21)7-5-6-10-20-17(22)23-18(2,3)4;1-10(4-2-3-7-15)11-5-6-13(14)12(8-11)9-16/h3*5-6,10-12,15-16,20-22,24,27H,7-9,13-14,17-19,23H2,1-4H3,(H,38,39);2*2-3,7-9,12-13,17-19,21,24H,4-6,10-11,14-16,20,32H2,1H3;2-3,7-10,12,14,24H,4-6,11,13H2,1H3;2-3,7-10,12-14H,4-6,11H2,1H3;8-9,11,13H,5-7,10,12H2,1-4H3,(H,21,22);8-9,11,13,21H,5-7,10,12H2,1-4H3,(H,20,22);5-6,8,10,16H,2-4,7,9,15H2,1H3/t2*24-;;2*21-;;;;;/m11.11...../s1
InChIKeyADJOGDPQYJYVDJ-DHBGSBMLSA-N
MW4485.85 g/mol
LogP64.46
Rot. Bonds97

About [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione

[5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione (PubChem CID 167532352) has the molecular formula C256H316BrCl10N15O28 and a molecular weight of 4485.85 g/mol. Its IUPAC name is [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione.

Molecular Properties

Compound Name[5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione
PubChem CID167532352
Molecular FormulaC256H316BrCl10N15O28
Molecular Weight4485.85 g/mol
Exact Mass4476.98
IUPAC Name[5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione
SMILESCC(CCCCN)c1ccc(Cl)c(CO)c1.CC(CCCCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)c(C=O)c1.CC(CCCCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)c(CO)c1.CC(CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(CBr)c1.CC(CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(CO)c1.CC(CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCN)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCN)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1
InChIInChI=1S/3C35H43ClN2O4.2C30H35ClN2O2.C21H22ClNO3.C21H20ClNO3.C18H27BrClNO2.C18H28ClNO3.C13H20ClNO/c3*1-24(9-7-8-19-38-33(39)42-34(2,3)4)25-12-15-31(36)26(21-25)23-40-35(17-18-35)30-22-37-20-16-28(30)29-10-5-6-11-32(29)41-27-13-14-27;2*1-21(6-4-5-16-32)22-9-12-28(31)23(18-22)20-34-30(14-15-30)27-19-33-17-13-25(27)26-7-2-3-8-29(26)35-24-10-11-24;2*1-14(15-9-10-19(22)16(12-15)13-24)6-4-5-11-23-20(25)17-7-2-3-8-18(17)21(23)26;1-13(14-8-9-16(20)15(11-14)12-19)7-5-6-10-21-17(22)23-18(2,3)4;1-13(14-8-9-16(19)15(11-14)12-21)7-5-6-10-20-17(22)23-18(2,3)4;1-10(4-2-3-7-15)11-5-6-13(14)12(8-11)9-16/h3*5-6,10-12,15-16,20-22,24,27H,7-9,13-14,17-19,23H2,1-4H3,(H,38,39);2*2-3,7-9,12-13,17-19,21,24H,4-6,10-11,14-16,20,32H2,1H3;2-3,7-10,12,14,24H,4-6,11,13H2,1H3;2-3,7-10,12-14H,4-6,11H2,1H3;8-9,11,13H,5-7,10,12H2,1-4H3,(H,21,22);8-9,11,13,21H,5-7,10,12H2,1-4H3,(H,20,22);5-6,8,10,16H,2-4,7,9,15H2,1H3/t2*24-;;2*21-;;;;;/m11.11...../s1
InChIKeyADJOGDPQYJYVDJ-DHBGSBMLSA-N
XLogP64.46
TPSA578.98 Ų
H-Bond Donors11
H-Bond Acceptors36
Rotatable Bonds97
Heavy Atoms310
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004485.85
LogP ≤ 564.46
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1036

Analyze [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione?
The IUPAC name of [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione (CID 167532352) is [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione.
What is the SMILES notation for [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione?
The canonical SMILES for [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione is CC(CCCCN)c1ccc(Cl)c(CO)c1.CC(CCCCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)c(C=O)c1.CC(CCCCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)c(CO)c1.CC(CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(CBr)c1.CC(CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(CO)c1.CC(CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCN)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCN)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.C[C@H](CCCCNC(=O)OC(C)(C)C)c1ccc(Cl)c(COC2(c3cnccc3-c3ccccc3OC3CC3)CC2)c1.
What is the InChIKey of [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione?
The InChIKey is ADJOGDPQYJYVDJ-DHBGSBMLSA-N. The full InChI is InChI=1S/3C35H43ClN2O4.2C30H35ClN2O2.C21H22ClNO3.C21H20ClNO3.C18H27BrClNO2.C18H28ClNO3.C13H20ClNO/c3*1-24(9-7-8-19-38-33(39)42-34(2,3)4)25-12-15-31(36)26(21-25)23-40-35(17-18-35)30-22-37-20-16-28(30)29-10-5-6-11-32(29)41-27-13-14-27;2*1-21(6-4-5-16-32)22-9-12-28(31)23(18-22)20-34-30(14-15-30)27-19-33-17-13-25(27)26-7-2-3-8-29(26)35-24-10-11-24;2*1-14(15-9-10-19(22)16(12-15)13-24)6-4-5-11-23-20(25)17-7-2-3-8-18(17)21(23)26;1-13(14-8-9-16(20)15(11-14)12-19)7-5-6-10-21-17(22)23-18(2,3)4;1-13(14-8-9-16(19)15(11-14)12-21)7-5-6-10-20-17(22)23-18(2,3)4;1-10(4-2-3-7-15)11-5-6-13(14)12(8-11)9-16/h3*5-6,10-12,15-16,20-22,24,27H,7-9,13-14,17-19,23H2,1-4H3,(H,38,39);2*2-3,7-9,12-13,17-19,21,24H,4-6,10-11,14-16,20,32H2,1H3;2-3,7-10,12,14,24H,4-6,11,13H2,1H3;2-3,7-10,12-14H,4-6,11H2,1H3;8-9,11,13H,5-7,10,12H2,1-4H3,(H,21,22);8-9,11,13,21H,5-7,10,12H2,1-4H3,(H,20,22);5-6,8,10,16H,2-4,7,9,15H2,1H3/t2*24-;;2*21-;;;;;/m11.11...../s1.
What are the key properties of [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione?
[5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione has a molecular weight of 4485.85 g/mol, XLogP of 64.46, 97 rotatable bonds, 11 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(6-aminohexan-2-yl)-2-chlorophenyl]methanol;tert-butyl N-[5-[3-(bromomethyl)-4-chlorophenyl]hexyl]carbamate;tert-butyl N-[5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate;bis(tert-butyl N-[(5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexyl]carbamate);tert-butyl N-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]carbamate;bis((5R)-5-[4-chloro-3-[[1-[4-(2-cyclopropyloxyphenyl)-3-pyridinyl]cyclopropyl]oxymethyl]phenyl]hexan-1-amine);2-chloro-5-[6-(1,3-dioxoisoindol-2-yl)hexan-2-yl]benzaldehyde;2-[5-[4-chloro-3-(hydroxymethyl)phenyl]hexyl]isoindole-1,3-dione is sourced from PubChem (CID 167532352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).