[(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate

C159H169N23O19 — CID 160993648

IUPAC[(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate
SMILESCCC[C@@H](OC(=O)NCc1ccc(C(=O)Nc2ccccc2N)cc1)c1ccc(CC)cc1.CCC[C@@H](OC(=O)NCc1ccc(C(=O)Nc2ccccc2N)cc1)c1ccc(OCCN(C)C)cc1.CC[C@H](NC(=O)O[C@@H](c1ccccc1)c1cccnc1)c1ccc(C(=O)Nc2ccccc2N)cc1.CC[C@H](OC(=O)N[C@@H](C)c1ccc(C(=O)Nc2ccccc2N)cc1)c1cccnc1.C[C@H](NC(=O)O[C@@H](C)c1cccnc1)c1ccc(C(=O)Nc2ccccc2N)cc1.Nc1ccccc1NC(=O)c1ccc([C@@H](NC(=O)OCc2cccnc2)c2ccccc2)cc1
InChIInChI=1S/C29H36N4O4.C29H28N4O3.C27H24N4O3.C27H31N3O3.C24H26N4O3.C23H24N4O3/c1-4-7-27(22-14-16-24(17-15-22)36-19-18-33(2)3)37-29(35)31-20-21-10-12-23(13-11-21)28(34)32-26-9-6-5-8-25(26)30;1-2-25(20-14-16-22(17-15-20)28(34)32-26-13-7-6-12-24(26)30)33-29(35)36-27(21-9-4-3-5-10-21)23-11-8-18-31-19-23;28-23-10-4-5-11-24(23)30-26(32)22-14-12-21(13-15-22)25(20-8-2-1-3-9-20)31-27(33)34-18-19-7-6-16-29-17-19;1-3-7-25(21-14-10-19(4-2)11-15-21)33-27(32)29-18-20-12-16-22(17-13-20)26(31)30-24-9-6-5-8-23(24)28;1-3-22(19-7-6-14-26-15-19)31-24(30)27-16(2)17-10-12-18(13-11-17)23(29)28-21-9-5-4-8-20(21)25;1-15(26-23(29)30-16(2)19-6-5-13-25-14-19)17-9-11-18(12-10-17)22(28)27-21-8-4-3-7-20(21)24/h5-6,8-17,27H,4,7,18-20,30H2,1-3H3,(H,31,35)(H,32,34);3-19,25,27H,2,30H2,1H3,(H,32,34)(H,33,35);1-17,25H,18,28H2,(H,30,32)(H,31,33);5-6,8-17,25H,3-4,7,18,28H2,1-2H3,(H,29,32)(H,30,31);4-16,22H,3,25H2,1-2H3,(H,27,30)(H,28,29);3-16H,24H2,1-2H3,(H,26,29)(H,27,28)/t27-;25-,27-;2*25-;16-,22-;15-,16-/m100100/s1
InChIKeyTUYMMGHSCQXJFP-AUCIXCPFSA-N
MW2706.24 g/mol
LogP31.21
Rot. Bonds49

About [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate

[(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate (PubChem CID 160993648) has the molecular formula C159H169N23O19 and a molecular weight of 2706.24 g/mol. Its IUPAC name is [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate.

Molecular Properties

Compound Name[(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate
PubChem CID160993648
Molecular FormulaC159H169N23O19
Molecular Weight2706.24 g/mol
Exact Mass2704.30
IUPAC Name[(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate
SMILESCCC[C@@H](OC(=O)NCc1ccc(C(=O)Nc2ccccc2N)cc1)c1ccc(CC)cc1.CCC[C@@H](OC(=O)NCc1ccc(C(=O)Nc2ccccc2N)cc1)c1ccc(OCCN(C)C)cc1.CC[C@H](NC(=O)O[C@@H](c1ccccc1)c1cccnc1)c1ccc(C(=O)Nc2ccccc2N)cc1.CC[C@H](OC(=O)N[C@@H](C)c1ccc(C(=O)Nc2ccccc2N)cc1)c1cccnc1.C[C@H](NC(=O)O[C@@H](C)c1cccnc1)c1ccc(C(=O)Nc2ccccc2N)cc1.Nc1ccccc1NC(=O)c1ccc([C@@H](NC(=O)OCc2cccnc2)c2ccccc2)cc1
InChIInChI=1S/C29H36N4O4.C29H28N4O3.C27H24N4O3.C27H31N3O3.C24H26N4O3.C23H24N4O3/c1-4-7-27(22-14-16-24(17-15-22)36-19-18-33(2)3)37-29(35)31-20-21-10-12-23(13-11-21)28(34)32-26-9-6-5-8-25(26)30;1-2-25(20-14-16-22(17-15-20)28(34)32-26-13-7-6-12-24(26)30)33-29(35)36-27(21-9-4-3-5-10-21)23-11-8-18-31-19-23;28-23-10-4-5-11-24(23)30-26(32)22-14-12-21(13-15-22)25(20-8-2-1-3-9-20)31-27(33)34-18-19-7-6-16-29-17-19;1-3-7-25(21-14-10-19(4-2)11-15-21)33-27(32)29-18-20-12-16-22(17-13-20)26(31)30-24-9-6-5-8-23(24)28;1-3-22(19-7-6-14-26-15-19)31-24(30)27-16(2)17-10-12-18(13-11-17)23(29)28-21-9-5-4-8-20(21)25;1-15(26-23(29)30-16(2)19-6-5-13-25-14-19)17-9-11-18(12-10-17)22(28)27-21-8-4-3-7-20(21)24/h5-6,8-17,27H,4,7,18-20,30H2,1-3H3,(H,31,35)(H,32,34);3-19,25,27H,2,30H2,1H3,(H,32,34)(H,33,35);1-17,25H,18,28H2,(H,30,32)(H,31,33);5-6,8-17,25H,3-4,7,18,28H2,1-2H3,(H,29,32)(H,30,31);4-16,22H,3,25H2,1-2H3,(H,27,30)(H,28,29);3-16H,24H2,1-2H3,(H,26,29)(H,27,28)/t27-;25-,27-;2*25-;16-,22-;15-,16-/m100100/s1
InChIKeyTUYMMGHSCQXJFP-AUCIXCPFSA-N
XLogP31.21
TPSA624.73 Ų
H-Bond Donors18
H-Bond Acceptors30
Rotatable Bonds49
Heavy Atoms201
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002706.24
LogP ≤ 531.21
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

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

Analyze [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate with MolForge

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Related Compounds

[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]-N-[2-(dimethylamino)ethyl]carbamate
CID 59544767
phosphoric acid;pyridin-3-ylmethyl N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate
CID 67397836
but-2-enedioic acid;pyridin-3-ylmethyl N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate
CID 67399081
(Z)-but-2-enedioic acid;pyridin-3-ylmethyl N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate
CID 67401386
pyridin-3-ylmethyl N-[[4-[3-(2-aminoanilino)-2-methyl-3-oxopropyl]phenyl]methyl]carbamate
CID 142222178
N'-hydroxy-N-phenyloctanediamide;pyridin-3-ylmethyl N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate
CID 42601430
N-(2-aminophenyl)-4-[[(4-pyridin-3-ylpyrimidin-2-yl)amino]methyl]benzamide;methane;pyridin-3-ylmethyl N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate
CID 160960136
pyridin-3-ylmethyl N-[[4-[(2-amino-4-methylphenyl)carbamoyl]phenyl]methyl]carbamate
CID 10572471
N-[3-oxo-1-phenyl-3-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethylamino]propyl]benzamide
CID 55693376
methyl N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;pyridine
CID 174424077
N-[3-oxo-1-phenyl-3-[[4-(pyridin-3-ylmethoxy)phenyl]methylamino]propyl]benzamide
CID 55707958
2-[(4-butoxybenzoyl)amino]-N-[(1S)-1-phenylethyl]benzamide
CID 8714570

Frequently Asked Questions

What is the IUPAC name of [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate?
The IUPAC name of [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate (CID 160993648) is [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate.
What is the SMILES notation for [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate?
The canonical SMILES for [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate is CCC[C@@H](OC(=O)NCc1ccc(C(=O)Nc2ccccc2N)cc1)c1ccc(CC)cc1.CCC[C@@H](OC(=O)NCc1ccc(C(=O)Nc2ccccc2N)cc1)c1ccc(OCCN(C)C)cc1.CC[C@H](NC(=O)O[C@@H](c1ccccc1)c1cccnc1)c1ccc(C(=O)Nc2ccccc2N)cc1.CC[C@H](OC(=O)N[C@@H](C)c1ccc(C(=O)Nc2ccccc2N)cc1)c1cccnc1.C[C@H](NC(=O)O[C@@H](C)c1cccnc1)c1ccc(C(=O)Nc2ccccc2N)cc1.Nc1ccccc1NC(=O)c1ccc([C@@H](NC(=O)OCc2cccnc2)c2ccccc2)cc1.
What is the InChIKey of [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate?
The InChIKey is TUYMMGHSCQXJFP-AUCIXCPFSA-N. The full InChI is InChI=1S/C29H36N4O4.C29H28N4O3.C27H24N4O3.C27H31N3O3.C24H26N4O3.C23H24N4O3/c1-4-7-27(22-14-16-24(17-15-22)36-19-18-33(2)3)37-29(35)31-20-21-10-12-23(13-11-21)28(34)32-26-9-6-5-8-25(26)30;1-2-25(20-14-16-22(17-15-20)28(34)32-26-13-7-6-12-24(26)30)33-29(35)36-27(21-9-4-3-5-10-21)23-11-8-18-31-19-23;28-23-10-4-5-11-24(23)30-26(32)22-14-12-21(13-15-22)25(20-8-2-1-3-9-20)31-27(33)34-18-19-7-6-16-29-17-19;1-3-7-25(21-14-10-19(4-2)11-15-21)33-27(32)29-18-20-12-16-22(17-13-20)26(31)30-24-9-6-5-8-23(24)28;1-3-22(19-7-6-14-26-15-19)31-24(30)27-16(2)17-10-12-18(13-11-17)23(29)28-21-9-5-4-8-20(21)25;1-15(26-23(29)30-16(2)19-6-5-13-25-14-19)17-9-11-18(12-10-17)22(28)27-21-8-4-3-7-20(21)24/h5-6,8-17,27H,4,7,18-20,30H2,1-3H3,(H,31,35)(H,32,34);3-19,25,27H,2,30H2,1H3,(H,32,34)(H,33,35);1-17,25H,18,28H2,(H,30,32)(H,31,33);5-6,8-17,25H,3-4,7,18,28H2,1-2H3,(H,29,32)(H,30,31);4-16,22H,3,25H2,1-2H3,(H,27,30)(H,28,29);3-16H,24H2,1-2H3,(H,26,29)(H,27,28)/t27-;25-,27-;2*25-;16-,22-;15-,16-/m100100/s1.
What are the key properties of [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate?
[(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate has a molecular weight of 2706.24 g/mol, XLogP of 31.21, 49 rotatable bonds, 18 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-[4-[2-(dimethylamino)ethoxy]phenyl]butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(1R)-1-(4-ethylphenyl)butyl] N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate;[(S)-phenyl(pyridin-3-yl)methyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]propyl]carbamate;[(1S)-1-pyridin-3-ylethyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(S)-[4-[(2-aminophenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]ethyl]carbamate is sourced from PubChem (CID 160993648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).