Name: Name:Benzoic acid,4-[(2-thienylcarbonyl)amino]-,2-(diethylamino)ethyl ester
Brand: Angene
SKU: AG003F1A
Rating: 90 (10 reviews)

Benzoic acid,4-[(2-thienylcarbonyl)amino]-,2-(diethylamino)ethyl ester

CAS No.:

712305-93-6

Catalog Number:

AG003F1A

Molecular Formula:

C18H22N2O3S

Molecular Weight:

346.4439

Catalog Number:

AG003F1A

Chemical Name:

Benzoic acid,4-[(2-thienylcarbonyl)amino]-,2-(diethylamino)ethyl ester

CAS Number:

712305-93-6

Molecular Formula:

C18H22N2O3S

Molecular Weight:

346.4439

MDL Number:

MFCD01037137

IUPAC Name:

2-(diethylamino)ethyl 4-(thiophene-2-carbonylamino)benzoate

InChI:

InChI=1S/C18H22N2O3S/c1-3-20(4-2)11-12-23-18(22)14-7-9-15(10-8-14)19-17(21)16-6-5-13-24-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,21)

InChI Key:

OXCGXXXRSQRTRD-UHFFFAOYSA-N

SMILES:

CCN(CCOC(=O)c1ccc(cc1)NC(=O)c1cccs1)CC

Complexity:

407

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

346.135g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

346.445g/mol

Monoisotopic Mass:

346.135g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4