769151-21-5
3-(2-((1-NAPHTHOYLAMINO)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
Name3-(2-((1-NAPHTHOYLAMINO)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
1Identification
【Name】
3-(2-((1-NAPHTHOYLAMINO)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
【CAS】
【MDL】
MFCD05153836
【English Synonyms】
【Formula】
C27 H20 Cl N3 O4
【MolWeight】
485.925
【Inchi】
InChI=1S/C27H20ClN3O4/c28-21-13-11-20(12-14-21)27(34)35-22-8-3-5-18(15-22)16-30-31-25(32)17-29-26(33)24-10-4-7-19-6-1-2-9-23(19)24/h1-16H,17H2,(H,29,33)(H,31,32)/b30-16+
【InChIKey】
InChIKey=VOVDLVUIJXTQIP-OKCVXOCRSA-N
【SMILES】
c1ccc2c(c1)cccc2C(=O)NCC(=O)N/N=C/c3cccc(c3)OC(=O)c4ccc(cc4)Cl
【MOL File】
3-(2-((1-NAPHTHOYLAM….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(2-((1-NAPHTHOYLAMINO)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE.cml