2-{[(1,3-dicarboxypropyl)carbamoyl]amino}pentanedioic acid

2-{[(1,3-dicarboxypropyl)carbamoyl]amino}pentanedioic acid

Formula: C11H16N2O9

SMILES: OC(=O)CCC(NC(=O)NC(CCC(O)=O)C(O)=O)C(O)=O

IUPAC: 2-{[(1,3-dicarboxypropyl)carbamoyl]amino}pentanedioic acid

InChI: InChI=1/C11H16N2O9/c14-7(15)3-1-5(9(18)19)12-11(22)13-6(10(20)21)2-4-8(16)17/h5-6H,1-4H2,(H,14,15)(H,16,17)(H,18,19)(H,20,21)(H2,12,13,22)

Composition: C (41.26%), H (5.04%), N (8.75%), O (44.96%)

Molar Mass: 320.254

Atom Count: 38

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	320.085580103
Formal Charge	0
FSP3	0.55
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	6
InChIKey	SOAPXKSPJAZNGO-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	65.67
Topological Polar Surface Area	190.33
Polarizability	26
Ring Count	0
Rotatable Bond Count	10

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C11H16N2O9		Quote Only