H-Arg(pbf)-ome hcl

C₂₀H₃₃ClN₄O₅SCAS 257288-19-0477.02 g/mol

Open in Covalent MOL file

Ester Ether Guanidine Primary amine Sulfonamide

Properties

Molecular formula: C₂₀H₃₃ClN₄O₅S
Molar mass: 477.02 g/mol
Exact mass: 476.1860 Da
logP: 1.62Crippen estimate
Polar surface area: 146.1 Å²
H-bond donors / acceptors: 3 / 7
Rotatable bonds: 7
Stereocentres: Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

257288-19-0

SMILES

CC1=C(C(=C(C2=C1OC(C2)(C)C)C)S(=O)(=O)NC(=NCCC[C@@H](C(=O)OC)N)N)C.Cl

InChIKey

YPQBZJQUKCGWKC-RSAXXLAASA-N

InChI

InChI=1S/C20H32N4O5S.ClH/c1-11-12(2)17(13(3)14-10-20(4,5)29-16(11)14)30(26,27)24-19(22)23-9-7-8-15(21)18(25)28-6;/h15H,7-10,21H2,1-6H3,(H3,22,23,24);1H/t15-;/m0./s1

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Similar compounds

(S)-2-(((Benzyloxy)carbonyl)(methyl)amino)-5-(3-((2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-yl)sulfonyl)guanidino)pentanoic acid2135655-88-653 % similar N5-[[[(2,3-Dihydro-2,2,4,6,7-pentamethyl-5-benzofuranyl)sulfonyl]amino]iminomethyl]-D-ornithine200116-81-052 % similar H-D-Arg(no2)-ome hcl50912-92-048 % similar N'-(4-Methoxy-2,3,6-trimethylphenylsulfonyl)-L-arginine80745-10-446 % similar H-D-Arg-ome 2hcl78851-84-045 % similar N5-[[[(2,3-Dihydro-2,2,4,6,7-pentamethyl-5-benzofuranyl)sulfonyl]amino]iminomethyl]-N2-[(1,1-dimethylethoxy)carbonyl]-D-ornithine186698-61-341 % similar Nε-tert-Butoxycarbonyllysine methyl ester hydrochloride2389-48-240 % similar 2,2,4,6,7-Pentamethyl-2,3-dihydrobenzofuran-5-sulfonamide378230-81-039 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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