Name: Name:4-(4-BENZYLMORPHOLIN-2-YL)PYRIMIDINE-5-CARBOXYLIC ACID
Brand: Angene
SKU: AG01DL7P
Rating: 90 (10 reviews)

4-(4-BENZYLMORPHOLIN-2-YL)PYRIMIDINE-5-CARBOXYLIC ACID

CAS No.:

1823266-78-9

Catalog Number:

AG01DL7P

Molecular Formula:

C16H17N3O3

Molecular Weight:

299.3245

Catalog Number:

AG01DL7P

Chemical Name:

4-(4-BENZYLMORPHOLIN-2-YL)PYRIMIDINE-5-CARBOXYLIC ACID

CAS Number:

1823266-78-9

Molecular Formula:

C16H17N3O3

Molecular Weight:

299.3245

MDL Number:

MFCD27997362

IUPAC Name:

4-(4-benzylmorpholin-2-yl)pyrimidine-5-carboxylic acid

InChI:

InChI=1S/C16H17N3O3/c20-16(21)13-8-17-11-18-15(13)14-10-19(6-7-22-14)9-12-4-2-1-3-5-12/h1-5,8,11,14H,6-7,9-10H2,(H,20,21)

InChI Key:

JYOQCODVRRQKBB-UHFFFAOYSA-N

SMILES:

OC(=O)c1cncnc1C1OCCN(C1)Cc1ccccc1

Complexity:

374

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

299.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

299.33g/mol

Monoisotopic Mass:

299.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.5