19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide

C116H148N12O15S3 — CID 161018278

IUPAC19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
SMILESCCCS(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC1(C(=O)N2CCC4(CCCN4)CC2)CC1c1cc(OC)ccc1-3.CCCS(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC1(C(=O)N2CCC4(CCCN4C)CC2)CC1c1cc(OC)ccc1-3.COc1ccc2c(c1)C1CC1(C(=O)N1CCC3(CCCN3C)CC1)Cn1c-2c(C2CCCCC2)c2ccc(C(=O)NS(=O)(=O)C(C)C)cc21
InChIInChI=1S/2C39H50N4O5S.C38H48N4O5S/c1-25(2)49(46,47)40-36(44)27-11-13-30-33(21-27)43-24-39(37(45)42-19-16-38(17-20-42)15-8-18-41(38)3)23-32(39)31-22-28(48-4)12-14-29(31)35(43)34(30)26-9-6-5-7-10-26;1-4-21-49(46,47)40-36(44)27-11-13-30-33(22-27)43-25-39(37(45)42-19-16-38(17-20-42)15-8-18-41(38)2)24-32(39)31-23-28(48-3)12-14-29(31)35(43)34(30)26-9-6-5-7-10-26;1-3-20-48(45,46)40-35(43)26-10-12-29-32(21-26)42-24-38(36(44)41-18-15-37(16-19-41)14-7-17-39-37)23-31(38)30-22-27(47-2)11-13-28(30)34(42)33(29)25-8-5-4-6-9-25/h11-14,21-22,25-26,32H,5-10,15-20,23-24H2,1-4H3,(H,40,44);11-14,22-23,26,32H,4-10,15-21,24-25H2,1-3H3,(H,40,44);10-13,21-22,25,31,39H,3-9,14-20,23-24H2,1-2H3,(H,40,43)
InChIKeyTYABWLXSUTZSNW-UHFFFAOYSA-N
MW2046.73 g/mol
LogP18.88
Rot. Bonds20

About 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide

19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide (PubChem CID 161018278) has the molecular formula C116H148N12O15S3 and a molecular weight of 2046.73 g/mol. Its IUPAC name is 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide.

Molecular Properties

Compound Name19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
PubChem CID161018278
Molecular FormulaC116H148N12O15S3
Molecular Weight2046.73 g/mol
Exact Mass2045.03
IUPAC Name19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
SMILESCCCS(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC1(C(=O)N2CCC4(CCCN4)CC2)CC1c1cc(OC)ccc1-3.CCCS(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC1(C(=O)N2CCC4(CCCN4C)CC2)CC1c1cc(OC)ccc1-3.COc1ccc2c(c1)C1CC1(C(=O)N1CCC3(CCCN3C)CC1)Cn1c-2c(C2CCCCC2)c2ccc(C(=O)NS(=O)(=O)C(C)C)cc21
InChIInChI=1S/2C39H50N4O5S.C38H48N4O5S/c1-25(2)49(46,47)40-36(44)27-11-13-30-33(21-27)43-24-39(37(45)42-19-16-38(17-20-42)15-8-18-41(38)3)23-32(39)31-22-28(48-4)12-14-29(31)35(43)34(30)26-9-6-5-7-10-26;1-4-21-49(46,47)40-36(44)27-11-13-30-33(22-27)43-25-39(37(45)42-19-16-38(17-20-42)15-8-18-41(38)2)24-32(39)31-23-28(48-3)12-14-29(31)35(43)34(30)26-9-6-5-7-10-26;1-3-20-48(45,46)40-35(43)26-10-12-29-32(21-26)42-24-38(36(44)41-18-15-37(16-19-41)14-7-17-39-37)23-31(38)30-22-27(47-2)11-13-28(30)34(42)33(29)25-8-5-4-6-9-25/h11-14,21-22,25-26,32H,5-10,15-20,23-24H2,1-4H3,(H,40,44);11-14,22-23,26,32H,4-10,15-21,24-25H2,1-3H3,(H,40,44);10-13,21-22,25,31,39H,3-9,14-20,23-24H2,1-2H3,(H,40,43)
InChIKeyTYABWLXSUTZSNW-UHFFFAOYSA-N
XLogP18.88
TPSA311.64 Ų
H-Bond Donors4
H-Bond Acceptors21
Rotatable Bonds20
Heavy Atoms146
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002046.73
LogP ≤ 518.88
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1021

Analyze 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide with MolForge

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Related Compounds

19-cyclohexyl-5-methoxy-N-propan-2-ylsulfonyl-10-(3,4,5-trimethylpiperazine-1-carbonyl)-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 74079067
(8S,10R)-19-cyclohexyl-5-methoxy-N-propan-2-ylsulfonyl-10-[7-(pyrrolidine-1-carbonyl)-3,7-diazatricyclo[3.3.2.01,5]decane-3-carbonyl]-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 46897118
(8S)-19-cyclohexyl-5-methoxy-10-(7-methyl-3,7,10-triazatricyclo[3.3.3.01,5]undecane-3-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 46897674
19-cyclohexyl-5-methoxy-10-(3-methyl-3,8-diazabicyclo[3.2.1]octane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 25018831
10-[(8S,10R)-19-cyclohexyl-5-methoxy-15-(propan-2-ylsulfonylcarbamoyl)-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-10-carbonyl]-N-methyl-3-oxa-7,10-diazatricyclo[3.3.3.01,5]undecane-7-carboxamide
CID 46896820
(8S,10R)-10-(3-acetyl-7-methyl-3,7,9-triazabicyclo[3.3.1]nonane-9-carbonyl)-19-cyclohexyl-N-(dimethylsulfamoyl)-5-methoxy-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;10-(3-acetyl-7-methyl-3,7,9-triazabicyclo[3.3.1]nonane-9-carbonyl)-19-cyclohexyl-5-methoxy-N-(2-methylpropylsulfonyl)-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;10-(3-acetyl-7-methyl-3,7,9-triazabicyclo[3.3.1]nonane-9-carbonyl)-19-cyclohexyl-5-methoxy-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 158635029
19-cyclohexyl-10-[2-[[ethyl(methyl)amino]methyl]pyrrolidine-1-carbonyl]-5-methoxy-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 71011923
19-cyclohexyl-10-(2,6-diazabicyclo[3.2.1]oct-1-ene-6-carbonyl)-5-methoxy-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 70996915
10-(4-acetyl-1,4-diazepane-1-carbonyl)-19-cyclohexyl-N-(dimethylsulfamoyl)-5-methoxy-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 25015603
(8S,10R)-19-cyclohexyl-5-methoxy-10-(3-methyl-3,8-diazabicyclo[3.2.1]octane-8-carbonyl)-N-pentan-3-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 59743038
10-[4-(4-cyanophenyl)piperidine-1-carbonyl]-19-cyclohexyl-N-(dimethylsulfamoyl)-5-methoxy-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 25015083
(8S,10R)-10-(9-acetyl-3-oxa-7,9-diazatricyclo[3.3.2.01,5]decane-7-carbonyl)-19-cyclohexyl-5-methoxy-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide
CID 59452516

Frequently Asked Questions

What is the IUPAC name of 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide?
The IUPAC name of 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide (CID 161018278) is 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide.
What is the SMILES notation for 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide?
The canonical SMILES for 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide is CCCS(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC1(C(=O)N2CCC4(CCCN4)CC2)CC1c1cc(OC)ccc1-3.CCCS(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC1(C(=O)N2CCC4(CCCN4C)CC2)CC1c1cc(OC)ccc1-3.COc1ccc2c(c1)C1CC1(C(=O)N1CCC3(CCCN3C)CC1)Cn1c-2c(C2CCCCC2)c2ccc(C(=O)NS(=O)(=O)C(C)C)cc21.
What is the InChIKey of 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide?
The InChIKey is TYABWLXSUTZSNW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C39H50N4O5S.C38H48N4O5S/c1-25(2)49(46,47)40-36(44)27-11-13-30-33(21-27)43-24-39(37(45)42-19-16-38(17-20-42)15-8-18-41(38)3)23-32(39)31-22-28(48-4)12-14-29(31)35(43)34(30)26-9-6-5-7-10-26;1-4-21-49(46,47)40-36(44)27-11-13-30-33(22-27)43-25-39(37(45)42-19-16-38(17-20-42)15-8-18-41(38)2)24-32(39)31-23-28(48-3)12-14-29(31)35(43)34(30)26-9-6-5-7-10-26;1-3-20-48(45,46)40-35(43)26-10-12-29-32(21-26)42-24-38(36(44)41-18-15-37(16-19-41)14-7-17-39-37)23-31(38)30-22-27(47-2)11-13-28(30)34(42)33(29)25-8-5-4-6-9-25/h11-14,21-22,25-26,32H,5-10,15-20,23-24H2,1-4H3,(H,40,44);11-14,22-23,26,32H,4-10,15-21,24-25H2,1-3H3,(H,40,44);10-13,21-22,25,31,39H,3-9,14-20,23-24H2,1-2H3,(H,40,43).
What are the key properties of 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide?
19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide has a molecular weight of 2046.73 g/mol, XLogP of 18.88, 20 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 19-cyclohexyl-10-(1,8-diazaspiro[4.5]decane-8-carbonyl)-5-methoxy-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propan-2-ylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide;19-cyclohexyl-5-methoxy-10-(1-methyl-1,8-diazaspiro[4.5]decane-8-carbonyl)-N-propylsulfonyl-12-azapentacyclo[10.7.0.02,7.08,10.013,18]nonadeca-1(19),2(7),3,5,13(18),14,16-heptaene-15-carboxamide is sourced from PubChem (CID 161018278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).