2-{2-[(tert-butoxycarbonyl)amino]acetamido}-5-carbamimidamidopentanoic acid

2-{2-[(tert-butoxycarbonyl)amino]acetamido}-5-carbamimidamidopentanoic acid

Formula: C13H25N5O5

SMILES: CC(C)(C)OC(=O)NCC(=O)NC(CCCNC(N)=N)C(O)=O

IUPAC: 2-(2-{[(tert-butoxy)carbonyl]amino}acetamido)-5-carbamimidamidopentanoic acid

InChI: InChI=1/C13H25N5O5/c1-13(2,3)23-12(22)17-7-9(19)18-8(10(20)21)5-4-6-16-11(14)15/h8H,4-7H2,1-3H3,(H,17,22)(H,18,19)(H,20,21)(H4,14,15,16)

Composition: C (47.12%), H (7.60%), N (21.13%), O (24.14%)

Molar Mass: 331.373

Atom Count: 48

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	331.185568925
Formal Charge	0
FSP3	0.69
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	6
InChIKey	MJKTURRULDXYQX-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	91.6
Topological Polar Surface Area	166.63
Polarizability	31.5
Ring Count	0
Rotatable Bond Count	10

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C13H25N5O5		Quote Only