bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide

C133H182Br6N17O37PS3 — CID 159133413

IUPACbis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide
SMILESCC(=O)c1cc(Br)ccc1O.CC(C)(C)[S@@](N)=O.CCOC(=O)N1CCC(=O)CC1.CCOC(=O)N1CCC2(CC1)CC(=N[S@@](=O)C(C)(C)C)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)CC(=O)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)C[C@H](N)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)C[C@H](NC(=O)c1cccc3cn(COP(=O)(O)O)nc13)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)C[C@H](N[S@@](=O)C(C)(C)C)c1cc(Br)ccc1O2.NC(CO)(CO)CO.NC(CO)(CO)CO.O=C(O)c1cccc2cn[nH]c12
InChIInChI=1S/C25H28BrN4O8P.C20H29BrN2O4S.C20H27BrN2O4S.C16H21BrN2O3.C16H18BrNO4.C8H7BrO2.C8H6N2O2.C8H13NO3.2C4H11NO3.C4H11NOS/c1-2-36-24(32)29-10-8-25(9-11-29)13-20(19-12-17(26)6-7-21(19)38-25)27-23(31)18-5-3-4-16-14-30(28-22(16)18)15-37-39(33,34)35;2*1-5-26-18(24)23-10-8-20(9-11-23)13-16(22-28(25)19(2,3)4)15-12-14(21)6-7-17(15)27-20;1-2-21-15(20)19-7-5-16(6-8-19)10-13(18)12-9-11(17)3-4-14(12)22-16;1-2-21-15(20)18-7-5-16(6-8-18)10-13(19)12-9-11(17)3-4-14(12)22-16;1-5(10)7-4-6(9)2-3-8(7)11;11-8(12)6-3-1-2-5-4-9-10-7(5)6;1-2-12-8(11)9-5-3-7(10)4-6-9;2*5-4(1-6,2-7)3-8;1-4(2,3)7(5)6/h3-7,12,14,20H,2,8-11,13,15H2,1H3,(H,27,31)(H2,33,34,35);6-7,12,16,22H,5,8-11,13H2,1-4H3;6-7,12H,5,8-11,13H2,1-4H3;3-4,9,13H,2,5-8,10,18H2,1H3;3-4,9H,2,5-8,10H2,1H3;2-4,11H,1H3;1-4H,(H,9,10)(H,11,12);2-6H2,1H3;2*6-8H,1-3,5H2;5H2,1-3H3/t20-;16-,28-;28-;13-;;;;;;;7-/m0000......0/s1
InChIKeyKHEHGEFFNWAVAI-MQMRNBQRSA-N
MW3217.60 g/mol
LogP19.68
Rot. Bonds22

About bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide

bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide (PubChem CID 159133413) has the molecular formula C133H182Br6N17O37PS3 and a molecular weight of 3217.60 g/mol. Its IUPAC name is bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide.

Molecular Properties

Compound Namebis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide
PubChem CID159133413
Molecular FormulaC133H182Br6N17O37PS3
Molecular Weight3217.60 g/mol
Exact Mass3209.69
IUPAC Namebis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide
SMILESCC(=O)c1cc(Br)ccc1O.CC(C)(C)[S@@](N)=O.CCOC(=O)N1CCC(=O)CC1.CCOC(=O)N1CCC2(CC1)CC(=N[S@@](=O)C(C)(C)C)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)CC(=O)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)C[C@H](N)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)C[C@H](NC(=O)c1cccc3cn(COP(=O)(O)O)nc13)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)C[C@H](N[S@@](=O)C(C)(C)C)c1cc(Br)ccc1O2.NC(CO)(CO)CO.NC(CO)(CO)CO.O=C(O)c1cccc2cn[nH]c12
InChIInChI=1S/C25H28BrN4O8P.C20H29BrN2O4S.C20H27BrN2O4S.C16H21BrN2O3.C16H18BrNO4.C8H7BrO2.C8H6N2O2.C8H13NO3.2C4H11NO3.C4H11NOS/c1-2-36-24(32)29-10-8-25(9-11-29)13-20(19-12-17(26)6-7-21(19)38-25)27-23(31)18-5-3-4-16-14-30(28-22(16)18)15-37-39(33,34)35;2*1-5-26-18(24)23-10-8-20(9-11-23)13-16(22-28(25)19(2,3)4)15-12-14(21)6-7-17(15)27-20;1-2-21-15(20)19-7-5-16(6-8-19)10-13(18)12-9-11(17)3-4-14(12)22-16;1-2-21-15(20)18-7-5-16(6-8-18)10-13(19)12-9-11(17)3-4-14(12)22-16;1-5(10)7-4-6(9)2-3-8(7)11;11-8(12)6-3-1-2-5-4-9-10-7(5)6;1-2-12-8(11)9-5-3-7(10)4-6-9;2*5-4(1-6,2-7)3-8;1-4(2,3)7(5)6/h3-7,12,14,20H,2,8-11,13,15H2,1H3,(H,27,31)(H2,33,34,35);6-7,12,16,22H,5,8-11,13H2,1-4H3;6-7,12H,5,8-11,13H2,1-4H3;3-4,9,13H,2,5-8,10,18H2,1H3;3-4,9H,2,5-8,10H2,1H3;2-4,11H,1H3;1-4H,(H,9,10)(H,11,12);2-6H2,1H3;2*6-8H,1-3,5H2;5H2,1-3H3/t20-;16-,28-;28-;13-;;;;;;;7-/m0000......0/s1
InChIKeyKHEHGEFFNWAVAI-MQMRNBQRSA-N
XLogP19.68
TPSA775.55 Ų
H-Bond Donors17
H-Bond Acceptors40
Rotatable Bonds22
Heavy Atoms197
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003217.60
LogP ≤ 519.68
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide?
The IUPAC name of bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide (CID 159133413) is bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide.
What is the SMILES notation for bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide?
The canonical SMILES for bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide is CC(=O)c1cc(Br)ccc1O.CC(C)(C)[S@@](N)=O.CCOC(=O)N1CCC(=O)CC1.CCOC(=O)N1CCC2(CC1)CC(=N[S@@](=O)C(C)(C)C)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)CC(=O)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)C[C@H](N)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)C[C@H](NC(=O)c1cccc3cn(COP(=O)(O)O)nc13)c1cc(Br)ccc1O2.CCOC(=O)N1CCC2(CC1)C[C@H](N[S@@](=O)C(C)(C)C)c1cc(Br)ccc1O2.NC(CO)(CO)CO.NC(CO)(CO)CO.O=C(O)c1cccc2cn[nH]c12.
What is the InChIKey of bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide?
The InChIKey is KHEHGEFFNWAVAI-MQMRNBQRSA-N. The full InChI is InChI=1S/C25H28BrN4O8P.C20H29BrN2O4S.C20H27BrN2O4S.C16H21BrN2O3.C16H18BrNO4.C8H7BrO2.C8H6N2O2.C8H13NO3.2C4H11NO3.C4H11NOS/c1-2-36-24(32)29-10-8-25(9-11-29)13-20(19-12-17(26)6-7-21(19)38-25)27-23(31)18-5-3-4-16-14-30(28-22(16)18)15-37-39(33,34)35;2*1-5-26-18(24)23-10-8-20(9-11-23)13-16(22-28(25)19(2,3)4)15-12-14(21)6-7-17(15)27-20;1-2-21-15(20)19-7-5-16(6-8-19)10-13(18)12-9-11(17)3-4-14(12)22-16;1-2-21-15(20)18-7-5-16(6-8-18)10-13(19)12-9-11(17)3-4-14(12)22-16;1-5(10)7-4-6(9)2-3-8(7)11;11-8(12)6-3-1-2-5-4-9-10-7(5)6;1-2-12-8(11)9-5-3-7(10)4-6-9;2*5-4(1-6,2-7)3-8;1-4(2,3)7(5)6/h3-7,12,14,20H,2,8-11,13,15H2,1H3,(H,27,31)(H2,33,34,35);6-7,12,16,22H,5,8-11,13H2,1-4H3;6-7,12H,5,8-11,13H2,1-4H3;3-4,9,13H,2,5-8,10,18H2,1H3;3-4,9H,2,5-8,10H2,1H3;2-4,11H,1H3;1-4H,(H,9,10)(H,11,12);2-6H2,1H3;2*6-8H,1-3,5H2;5H2,1-3H3/t20-;16-,28-;28-;13-;;;;;;;7-/m0000......0/s1.
What are the key properties of bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide?
bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide has a molecular weight of 3217.60 g/mol, XLogP of 19.68, 22 rotatable bonds, 17 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-amino-2-(hydroxymethyl)propane-1,3-diol);1-(5-bromo-2-hydroxyphenyl)ethanone;ethyl (4S)-4-amino-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[(S)-tert-butylsulfinyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-[(S)-tert-butylsulfinyl]iminospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl 6-bromo-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;ethyl (4S)-6-bromo-4-[[2-(phosphonooxymethyl)indazole-7-carbonyl]amino]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate;ethyl 4-oxopiperidine-1-carboxylate;1H-indazole-7-carboxylic acid;(S)-2-methylpropane-2-sulfinamide is sourced from PubChem (CID 159133413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).