| Catalog Number | ACM1207293364 |
| CAS | 1207293-36-4 |
| IUPAC Name | 3-[3-[N-[4-[(dimethylamino)methyl]phenyl]-C-phenylcarbonimidoyl]-2-hydroxy-1H-indol-6-yl]-N-ethylprop-2-ynamide |
| Synonyms | BI-847325;1207293-36-4;(Z)-3-(3-(((4-((dimethylamino)methyl)phenyl)amino)(phenyl)methylene)-2-oxoindolin-6-yl)-N-ethylpropiolamide;3-[(3~{z})-3-[[[4-[(Dimethylamino)methyl]phenyl]amino]-Phenyl-Methylidene]-2-Oxidanylidene-1~{h}-Indol-6-Yl]-~{n}-Ethyl-Prop-2-Ynamide;hylpropiolamide;(Z)-3-(3-((4-((dimethylamino)methyl)phenylamino)(phenyl)methylene)-2-oxoindolin-6-yl)-N-ethylpropiolamide;BI 847325;5U5;SCHEMBL4081822;CHEMBL3699142;CHEMBL4303500;SCHEMBL10326049;BDBM142744;BCP15994;EX-A1727;NSC799360;s7843;AKOS030238788;ZINC143989489;ZINC143989696;ACN-037512;CCG-269395;CS-6291;NSC-799360;SB23246;NCGC00481575-01;AC-29870;AK198901;AS-56076;HY-18955;US8937095, 6;Q27456034;2128698-24-6;3-[(3Z)-3-[({4-[(dimethylamino)methyl]phenyl}amino)(phenyl)methylidene]-2-oxo-2,3-dihydro-1H-indol-6-yl]-N-ethylprop-2-ynamide;3-[(3Z)-3-[[4-[(dimethylamino)methyl]anilino]-phenylmethylidene]-2-oxo-1H-indol-6-yl]-N-ethylprop-2-ynamide;3-[3-[[[4-[(Dimethylamino)methyl]phenyl]amino]phenylmethylene]-2,3-dihydro-2-oxo-1H-indol-6-yl]-N-ethyl-2-propynamide;3-[3-[[4-[(dimethylamino)methyl]anilino]-phenylmethylidene]-2-oxo-1H-indol-6-yl]-N-ethylprop-2-ynamide |
| Molecular Weight | 464.6g/mol |
| Molecular Formula | C29H28N4O2 |
| Canonical SMILES | CCNC(=O)C#CC1=CC2=C(C=C1)C(=C(N2)O)C(=NC3=CC=C(C=C3)CN(C)C)C4=CC=CC=C4 |
| InChI | InChI=1S/C29H28N4O2/c1-4-30-26(34)17-13-20-12-16-24-25(18-20)32-29(35)27(24)28(22-8-6-5-7-9-22)31-23-14-10-21(11-15-23)19-33(2)3/h5-12,14-16,18,32,35H,4,19H2,1-3H3,(H,30,34) |
| InChI Key | OCUQMWSIGPQEMX-UHFFFAOYSA-N |
| Complexity | 798 |
| Covalently-Bonded Unit Count | 1 |
| Exact Mass | 464.22122615g/mol |
| Heavy Atom Count | 35 |
| Hydrogen Bond Acceptor Count | 4 |
| Monoisotopic Mass | 464.22122615g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 80.7Ų |
| X Log P3 | 5.3 |