Name: Name:Pyrido[3,4-d]pyriMidine-7(6H)-carboxylic acid, 2-[4-[[(ethylaMino)carbonyl]aMino]phenyl]-5,8-dihydro-4-[(3S)-3-Methyl-4-Morpholinyl]-, 1,1-diMethylethyl ester
Brand: Angene
SKU: AG008TJ7
Rating: 90 (10 reviews)

Pyrido[3,4-d]pyriMidine-7(6H)-carboxylic acid, 2-[4-[[(ethylaMino)carbonyl]aMino]phenyl]-5,8-dihydro-4-[(3S)-3-Methyl-4-Morpholinyl]-, 1,1-diMethylethyl ester

CAS No.:

1207365-47-6

Catalog Number:

AG008TJ7

Molecular Formula:

C26H36N6O4

Molecular Weight:

496.6018

Catalog Number:

AG008TJ7

Chemical Name:

Pyrido[3,4-d]pyriMidine-7(6H)-carboxylic acid, 2-[4-[[(ethylaMino)carbonyl]aMino]phenyl]-5,8-dihydro-4-[(3S)-3-Methyl-4-Morpholinyl]-, 1,1-diMethylethyl ester

CAS Number:

1207365-47-6

Molecular Formula:

C26H36N6O4

Molecular Weight:

496.6018

MDL Number:

MFCD25977334

IUPAC Name:

tert-butyl 2-[4-(ethylcarbamoylamino)phenyl]-4-[(3S)-3-methylmorpholin-4-yl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylate

InChI:

InChI=1S/C26H36N6O4/c1-6-27-24(33)28-19-9-7-18(8-10-19)22-29-21-15-31(25(34)36-26(3,4)5)12-11-20(21)23(30-22)32-13-14-35-16-17(32)2/h7-10,17H,6,11-16H2,1-5H3,(H2,27,28,33)/t17-/m0/s1

InChI Key:

NLPOHPJVDDEGHU-KRWDZBQOSA-N

SMILES:

CCNC(=O)Nc1ccc(cc1)c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)C(=O)OC(C)(C)C

Complexity:

753

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

496.28g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

496.612g/mol

Monoisotopic Mass:

496.28g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

109A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5