AC1LXNWV
14,14-dimethyl-N-(2-phenylethyl)-13-oxa-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide
Also Known As: 10,10-dimethyl-N-(2-phenylethyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide|10,10-dimethyl-N-phenethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
| Molecular Formula | C21H21N5O2S |
|---|---|
| Molecular Weight | 407.1416 g/mol |
| LogP | 3.1628 |
| Topological Polar Surface Area | 81.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.1416 |
| Monoisotopic Mass | 407.1416 |
| Heavy Atoms | 29 |
| Complexity | 1212.2485 |
Chemical Identifiers
| CAS Number | 896832-19-2 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C4=NC(=NN4C=N3)C(=O)NCCC5=CC=CC=C5)C |
Product Overview
AC1LXNWV (CAS 896832-19-2), with molecular formula C21H21N5O2S and molecular weight 407.1416 g/mol. IUPAC: 14,14-dimethyl-N-(2-phenylethyl)-13-oxa-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide.
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