Name: Name:2-{[(4-aminoquinazolin-2-yl)methyl]sulfanyl}acetic acid
Brand: Angene
SKU: AG01A355
Rating: 90 (10 reviews)

2-{[(4-aminoquinazolin-2-yl)methyl]sulfanyl}acetic acid

CAS No.:

1094703-32-8

Catalog Number:

AG01A355

Molecular Formula:

C11H11N3O2S

Molecular Weight:

249.2889

Catalog Number:

AG01A355

Chemical Name:

2-{[(4-aminoquinazolin-2-yl)methyl]sulfanyl}acetic acid

CAS Number:

1094703-32-8

Molecular Formula:

C11H11N3O2S

Molecular Weight:

249.2889

MDL Number:

MFCD11647904

IUPAC Name:

2-[(4-aminoquinazolin-2-yl)methylsulfanyl]acetic acid

InChI:

InChI=1S/C11H11N3O2S/c12-11-7-3-1-2-4-8(7)13-9(14-11)5-17-6-10(15)16/h1-4H,5-6H2,(H,15,16)(H2,12,13,14)

InChI Key:

OPSWYGKIHTYDSZ-UHFFFAOYSA-N

SMILES:

OC(=O)CSCc1nc(N)c2c(n1)cccc2

Complexity:

277

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

249.057g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

249.288g/mol

Monoisotopic Mass:

249.057g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

114A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3