| CAS Number | 1052147-86-0 |
| Catalog Number | AG01EODO(AGN-PC-0WOQ60) |
| Chemical Name | LP-211 |
| IUPAC Name | N-[(4-cyanophenyl)methyl]-6-[4-(2-phenylphenyl)piperazin-1-yl]hexanamide |
| InChI | InChI=1S/C30H34N4O/c31-23-25-14-16-26(17-15-25)24-32-30(35)13-5-2-8-18-33-19-21-34(22-20-33)29-12-7-6-11-28(29)27-9-3-1-4-10-27/h1,3-4,6-7,9-12,14-17H,2,5,8,13,18-22,24H2,(H,32,35) |
| InChI Key | BQEDZLDNNBDKDS-UHFFFAOYSA-N |
| MDL Number | MFCD22690843 |
| Molecular Formula | C30H34N4O |
| Molecular Weight | 466.6172 |
| SMILES | O=C(NCC1=CC=C(C#N)C=C1)CCCCCN(CC2)CCN2C3=CC=CC=C3C4=CC=CC=C4 |
| Synonyms | LP-211,
N-(4-cyanophenylmethyl)-4-(2-diphenyl)-1-piperazinehexanamide,
LP-211,
1052147-86-0,
CHEMBL522691,
compound 25 [PMID 18800769],
GTPL8436,
KS-00002WTQ,
BDBM50253281,
ZINC40424136,
AKOS016340412,
HG-0230,
HY-111455,
LP-211, >=98% (HPLC),
CS-0040944,
A16898,
LP-211; LP 211; LP2111052147-86-0,
N-(4-Cyanophenylmethyl)-4-(2-diphenyl)-1-piperazinehexanamide,
N-[(4-cyanophenyl)methyl]-6-[4-(2-phenylphenyl)piperazin-1-yl]hexanamide,
D00GSD,
|
| Complexity | 665 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 466.273g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 35 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 466.629g/mol |
| Monoisotopic Mass | 466.273g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 59.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number