510712-22-8
3-HYDROXY-4-(4-ISOPROPOXY-3-METHYLBENZOYL)-1-[3-(4-MORPHOLINYL)PROPYL]-5-(3-PYRIDINYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE
Name3-HYDROXY-4-(4-ISOPROPOXY-3-METHYLBENZOYL)-1-[3-(4-MORPHOLINYL)PROPYL]-5-(3-PYRIDINYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE
1Identification
【Name】
3-HYDROXY-4-(4-ISOPROPOXY-3-METHYLBENZOYL)-1-[3-(4-MORPHOLINYL)PROPYL]-5-(3-PYRIDINYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE
【CAS】
【MDL】
MFCD03680296
【English Synonyms】
【Formula】
C27 H33 N3 O5
【MolWeight】
479.574
【Inchi】
InChI=1S/C27H33N3O5/c1-18(2)35-22-8-7-20(16-19(22)3)25(31)23-24(21-6-4-9-28-17-21)30(27(33)26(23)32)11-5-10-29-12-14-34-15-13-29/h4,6-9,16-18,24,32H,5,10-15H2,1-3H3
【InChIKey】
InChIKey=UCXIZONMXWKORX-UHFFFAOYSA-N
【SMILES】
Cc1cc(ccc1OC(C)C)C(=O)C2=C(C(=O)N(C2c3cccnc3)CCCN4CCOCC4)O
【MOL File】
3-HYDROXY-4-(4-ISOPR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-HYDROXY-4-(4-ISOPROPOXY-3-METHYLBENZOYL)-1-[3-(4-MORPHOLINYL)PROPYL]-5-(3-PYRIDINYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE.cml