2-ethoxy-4-[14-(4-methoxyphenyl)-12-oxo-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-10-yl]phenyl cyclohexanecarboxylate

2-ethoxy-4-[14-(4-methoxyphenyl)-12-oxo-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-10-yl]phenyl cyclohexanecarboxylate

Formula: C35H38N2O5

SMILES: CCOC1=CC(=CC=C1OC(=O)C1CCCCC1)C1NC2=CC=CC=C2NC2=C1C(=O)CC(C2)C1=CC=C(OC)C=C1

IUPAC: 2-ethoxy-4-[14-(4-methoxyphenyl)-12-oxo-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-10-yl]phenyl cyclohexanecarboxylate

InChI: InChI=1/C35H38N2O5/c1-3-41-32-21-24(15-18-31(32)42-35(39)23-9-5-4-6-10-23)34-33-29(36-27-11-7-8-12-28(27)37-34)19-25(20-30(33)38)22-13-16-26(40-2)17-14-22/h7-8,11-18,21,23,25,34,36-37H,3-6,9-10,19-20H2,1-2H3

Composition: C (74.18%), H (6.76%), N (4.94%), O (14.12%)

Molar Mass: 566.698

Atom Count: 80

Heavy Atom Count: 42

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	2
Exact Mass	566.278072332
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	IGNPKMXLTWQTIX-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	166.38
Topological Polar Surface Area	85.89
Polarizability	62.84
Ring Count	6
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C35H38N2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00