Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C27H28N4O2.ClH.H2O |
Molecular Weight | 495.013 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.CNC(=O)CN1C(=O)N(C2CCN(CC2)[C@@H]3CC4=C5C3=CC=CC5=CC=C4)C6=CC=CC=C16
InChI
InChIKey=NZSPJWUQIIWTKM-PPLJNSMQSA-N
InChI=1S/C27H28N4O2.ClH.H2O/c1-28-25(32)17-30-22-10-2-3-11-23(22)31(27(30)33)20-12-14-29(15-13-20)24-16-19-8-4-6-18-7-5-9-21(24)26(18)19;;/h2-11,20,24H,12-17H2,1H3,(H,28,32);1H;1H2/t24-;;/m1../s1
Molecular Formula | C27H28N4O2 |
Molecular Weight | 440.5368 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | H2O |
Molecular Weight | 18.0153 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:18:04 GMT 2023
by
admin
on
Fri Dec 15 16:18:04 GMT 2023
|
Record UNII |
5WZD1PYF5L
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Record Status |
Validated (UNII)
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Record Version |
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-
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91667649
Created by
admin on Fri Dec 15 16:18:04 GMT 2023 , Edited by admin on Fri Dec 15 16:18:04 GMT 2023
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PRIMARY | |||
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5WZD1PYF5L
Created by
admin on Fri Dec 15 16:18:04 GMT 2023 , Edited by admin on Fri Dec 15 16:18:04 GMT 2023
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PRIMARY | |||
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1215859-98-5
Created by
admin on Fri Dec 15 16:18:04 GMT 2023 , Edited by admin on Fri Dec 15 16:18:04 GMT 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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1215859-92-9
Created by
admin on Fri Dec 15 16:18:04 GMT 2023 , Edited by admin on Fri Dec 15 16:18:04 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |