2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-5-{[(4-methoxyphenyl)diphenylmethyl]amino}pentanoic acid

2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-5-{[(4-methoxyphenyl)diphenylmethyl]amino}pentanoic acid

Formula: C40H38N2O5

SMILES: COC1=CC=C(C=C1)C(NCCCC(NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O)(C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: 2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5-{[(4-methoxyphenyl)diphenylmethyl]amino}pentanoic acid

InChI: InChI=1/C40H38N2O5/c1-46-31-24-22-30(23-25-31)40(28-13-4-2-5-14-28,29-15-6-3-7-16-29)41-26-12-21-37(38(43)44)42-39(45)47-27-36-34-19-10-8-17-32(34)33-18-9-11-20-35(33)36/h2-11,13-20,22-25,36-37,41H,12,21,26-27H2,1H3,(H,42,45)(H,43,44)

Composition: C (76.66%), H (6.11%), N (4.47%), O (12.76%)

Molar Mass: 626.753

Atom Count: 85

Heavy Atom Count: 47

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	1
Exact Mass	626.278072332
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	IZNIVWXIXGXKJI-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	183.58
Topological Polar Surface Area	96.89
Polarizability	72.38
Ring Count	6
Rotatable Bond Count	14

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C40H38N2O5		Quote Only