(2S)-1-(2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}acetyl)pyrrolidine-2-carboxylic acid

(2S)-1-(2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}acetyl)pyrrolidine-2-carboxylic acid

CAS: 212651-48-4

Formula: C22H22N2O5

SMILES: OC(=O)[C@@H]1CCCN1C(=O)CNC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12

IUPAC: (2S)-1-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)acetyl]pyrrolidine-2-carboxylic acid

InChI: InChI=1S/C22H22N2O5/c25-20(24-11-5-10-19(24)21(26)27)12-23-22(28)29-13-18-16-8-3-1-6-14(16)15-7-2-4-9-17(15)18/h1-4,6-9,18-19H,5,10-13H2,(H,23,28)(H,26,27)/t19-/m0/s1

Composition: C (66.99%), H (5.62%), N (7.10%), O (20.28%)

Molar Mass: 394.427

Atom Count: 51

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	394.152871816
Formal Charge	0
FSP3	0.32
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	HPTFPWMPQFBSHP-IBGZPJMESA-N
Lipinski's Rule of Five	1
Molar Refractivity	105.07
Topological Polar Surface Area	95.94
Polarizability	41.85
Ring Count	4
Rotatable Bond Count	6

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	212651-48-4		$112.32-$551.04$112.32$344.64$551.04