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Name |
1-(4-Benziloxy-3-formylaminophenyl)-2-[N-benzyl-2'-(4-methoxyphenyl)-1'-methylethylamino]ethaol hemifumarate |
EINECS | N/A |
CAS No. | 143687-24-5 | Density | N/A |
PSA | 216.66000 | LogP | 13.14820 |
Solubility | N/A | Melting Point |
N/A |
Formula | 2(C33H36N2O4).C4H4O4 | Boiling Point | N/A |
Molecular Weight | 640.733 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1-(4-Benziloxy-3-formylaminophenyl)-2-[N-benzyl-2-(4-methoxyphenyl)-1-methylethylamino]ethaol hemifumarate; |
The 1-(4-Benziloxy-3-formylaminophenyl)-2-[N-benzyl-2'-(4-methoxyphenyl)-1'-methylethylamino]ethaol hemifumarate is an organic compound with the formula 2(C33H36N2O4).C4H4O4. The IUPAC name of this chemical is N-[5-(2-{benzyl[1-(4-methoxyphenyl)propan-2-yl]amino}-1-hydroxyethyl)-2-(benzyloxy)phenyl]formamide (2Z)-but-2-enedioate (2:1). With the CAS registry number 143687-24-5, it is also named as formamide, N-[5-[1-hydroxy-2-[[2-(4-methoxyphenyl)-1-methylethyl](phenylmethyl)amino]ethyl]-2-(phenylmethoxy)phenyl]-, (2Z)-2-butenedioate (2:1) (salt).
You can still convert the following datas into molecular structure:
(1)SMILES: CC(Cc1ccc(cc1)OC)N(Cc2ccccc2)CC(c3ccc(c(c3)NC=O)OCc4ccccc4)O.CC(Cc1ccc(cc1)OC)N(Cc2ccccc2)CC(c3ccc(c(c3)NC=O)OCc4ccccc4)O.C(=CC(=O)O)C(=O)O
(2)InChI: InChI=1/2C33H36N2O4.C4H4O4/c2*1-25(19-26-13-16-30(38-2)17-14-26)35(21-27-9-5-3-6-10-27)22-32(37)29-15-18-33(31(20-29)34-24-36)39-23-28-11-7-4-8-12-28;5-3(6)1-2-4(7)8/h2*3-18,20,24-25,32,37H,19,21-23H2,1-2H3,(H,34,36);1-2H,(H,5,6)(H,7,8)/b;;2-1-
(3)InChIKey: NKMRGAZUAPZJPZ-KSBRXOFIBS
(4)Std. InChI: InChI=1S/2C33H36N2O4.C4H4O4/c2*1-25(19-26-13-16-30(38-2)17-14-26)35(21-27-9-5-3-6-10-27)22-32(37)29-15-18-33(31(20-29)34-24-36)39-23-28-11-7-4-8-12-28;5-3(6)1-2-4(7)8/h2*3-18,20,24-25,32,37H,19,21-23H2,1-2H3,(H,34,36);1-2H,(H,5,6)(H,7,8)/b;;2-1-
(5)Std. InChIKey: NKMRGAZUAPZJPZ-KSBRXOFISA-N