AG0019EB

138529-46-1 | 1H-Thieno[3,4-d]imidazole-4-pentanamide, N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]hexahydro-2-oxo-, (3aS,4S,6aR)-

AG0019EB

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CAS Number	138529-46-1
Catalog Number	AG0019EB(AGN-PC-0PMVNK)
Chemical Name	1H-Thieno[3,4-d]imidazole-4-pentanamide, N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]hexahydro-2-oxo-, (3aS,4S,6aR)-
IUPAC Name	5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]pentanamide
InChI	InChI=1S/C16H30N4O4S/c17-5-7-23-9-10-24-8-6-18-14(21)4-2-1-3-13-15-12(11-25-13)19-16(22)20-15/h12-13,15H,1-11,17H2,(H,18,21)(H2,19,20,22)/t12-,13-,15-/m0/s1
InChI Key	LWISPDYGRSGXME-YDHLFZDLSA-N
MDL Number	MFCD09264745
Molecular Formula	C16H30N4O4S
Molecular Weight	374.4988
SMILES	NCCOCCOCCNC(CCCC[C@@H]1SC[C@@H]2NC(N[C@@H]21)=O)=O
Synonyms	138529-46-1, Biotin-DADOO, (+)-Biotin-(PEO)3-amine, Biotin-PEG2-Amine, N-BIOTINYL-3,6-DIOXAOCTANE-1,8-DIAMINE, (+)-Biotin-PEG2-CH2CH2NH2, N-[2-[2-(2-Aminoethoxy)ethoxy]ethyl] biotinamide, aminobiotin, (+)-Biotin-PEG2-amine, (+)-Biotin-PEG2-NH2, BIPG1207, SCHEMBL3179829, LWISPDYGRSGXME-YDHLFZDLSA-N, N-Biotinyl-3,6-dioxaoctanediamine, BCP24879, HY-D0980, 7496AH, MFCD09264745, ZINC34505675, BP-20671, n-(8-amino-3,6-dioxaoctanyl)biotinamide, n-(8-amino-3,6-dioxaoctanyl) biotinamide, N-biotinoyl-1,8-diamino-3,6-dioxaoctane, CS-0028293, A1-06587, J-007153, Biotin-PEG2-NH2, C16H30N4O4S, CID11199678, CID 11199678, N-Biotinyl-3,6-dioxa-1,8-octanediamine, A-7200,

Complexity	427
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	374.199g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	374.5g/mol
Monoisotopic Mass	374.199g/mol
Rotatable Bond Count	13
Topological Polar Surface Area	140A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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