| CAS Number | 1130067-06-9 |
| Catalog Number | AG0081MP(AGN-PC-0WAHKK) |
| Chemical Name | VU0155069 |
| IUPAC Name | N-[(2S)-1-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propan-2-yl]naphthalene-2-carboxamide;hydrochloride |
| InChI | InChI=1S/C26H27ClN4O2.ClH/c1-17(28-25(32)20-7-6-18-4-2-3-5-19(18)14-20)16-30-12-10-22(11-13-30)31-24-9-8-21(27)15-23(24)29-26(31)33;/h2-9,14-15,17,22H,10-13,16H2,1H3,(H,28,32)(H,29,33);1H/t17-;/m0./s1 |
| InChI Key | RQULTQQAHGYYDG-LMOVPXPDSA-N |
| MDL Number | MFCD23160355 |
| Molecular Formula | C26H28Cl2N4O2 |
| Molecular Weight | 499.4321 |
| SMILES | C[C@H](NC(=O)c1ccc2c(c1)cccc2)CN1CCC(CC1)n1c(=O)[nH]c2c1ccc(c2)Cl.Cl |
| Synonyms | N-(1-(4-(5-chloro-2-oxo-2,3-dihydro-1H-benzo(d)imidazol-1-yl)piperidin-1-yl)propan-2-yl)-2-naphthamide,
VU0155069,
1130067-06-9,
VU0155069,
VU 0155069,
vu-0155069,
CTK8E6843,
BCP29256,
EX-A2008,
AKOS024457696,
RT-017615,
B7434,
N-[(1S)-2-[4-(5-Chloro-2,3-dihydro-2-oxo-1H-benzimidazol-1-yl)-1-piperidinyl]-1-methylethyl-2-naphthalenecarboxamide,
RQULTQQAHGYYDG-LMOVPXPDSA-N,
(S)-WAY 100135 dihydrochloride,
(S)-N-(1-(4-(5-Chloro-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)piperidin-1-yl)propan-2-yl)-2-naphthamide,
N-(1S)-2-[4-(5-CHLORO-2,3-DIHYDRO-2-OXO-1H-BENZIMIDAZOL-1-YL)-1-PIPERIDINYL]-1-METHYLETHYL-2-NAPHTHALENECARBOXAMIDE,
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| Complexity | 712 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 498.159g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 34 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 499.436g/mol |
| Monoisotopic Mass | 498.159g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 64.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number