Y-27152 100mg

CAT: 0628-A20021-100Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0628-A20021-100Size:100 mg

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CAS Number

127408-30-4

Chemical Information

N-((3S,4R)-6-Cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl)-N-(phenylmethoxy)acetamide

N-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-N-phenylmethoxyacetamide is a 1-benzopyran.

CAS Number	127408-30-4
PubChem CID	6918184
IUPAC Name	N-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-N-phenylmethoxyacetamide
Molecular Formula	C21H22N2O4
Molecular Weight	366.4
XLogP	2.3
Topological Polar Surface Area	82.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	27
Formal Charge	0
Complexity	578

SMILES

CC(=O)N([C@H]1[C@@H](C(OC2=C1C=C(C=C2)C#N)(C)C)O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-14(24)23(26-13-15-7-5-4-6-8-15)19-17-11-16(12-22)9-10-18(17)27-21(2,3)20(19)25/h4-11,19-20,25H,13H2,1-3H3/t19-,20+/m1/s1

InChIKey

RHFUXPCCELGMFC-UXHICEINSA-N

Chemical Structure

2D Structure

CAS: 127408-30-4

CID: 6918184

Formula: C21H22N2O4

MW: 366.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	366.4
XLogP3	2.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	366.15795719
Monoisotopic Mass	366.15795719
Topological Polar Surface Area	82.8 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	578
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
HY-108582	Y-27152
341077	Y 27152
RP019411	MGC:27152 Recombinant Protein (Human)
28478011	MGC:27152 ORF Vector (Human) (pORF)
28478101	MGC-27152 AAV Vector (Human) (CMV)
PV025884	MGC:27152 Protein Vector (Human) (pPM-C-His)
PV025881	MGC:27152 Protein Vector (Human) (pPB-C-His)
28478021	MGC:27152 Protein Vector (Human) (pPM-C-HA)
PV025882	MGC:27152 Protein Vector (Human) (pPB-N-His)
TE-200	Thymalin 100mg +Epithalon 100mg