AC1MWBTQ
6-imino-13-methyl-2-oxo-N-(1-phenylethyl)-7-(3-propan-2-yloxypropyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: 6-imino-13-methyl-2-oxo-N-(1-phenylethyl)-7-[3-(propan-2-yloxy)propyl]-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide|2-IMINO-1-(3-ISOPROPOXYPROPYL)-8-METHYL-5-OXO-N-(1-PHENYLETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2',3'-D]PYRIMIDINE-3-CARBOXAMIDE|2-imino-1-(3-isopropoxypropyl)-8-methyl-5-oxo-N-(1-phenylethyl)-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide|2-imino-8-methyl-5-oxo-N-(1-phenylethyl)-1-[3-(propan-2-yloxy)propyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C27H31N5O3 |
|---|---|
| Molecular Weight | 473.24268 g/mol |
| LogP | 3.74319 |
| Topological Polar Surface Area | 101.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 473.24268 |
| Monoisotopic Mass | 473.24268 |
| Heavy Atoms | 35 |
| Complexity | 1488.4956 |
Chemical Identifiers
| CAS Number | 844652-50-2 |
|---|---|
| SMILES | CC1=CN2C(=NC3=C(C2=O)C=C(C(=N)N3CCCOC(C)C)C(=O)NC(C)C4=CC=CC=C4)C=C1 |
Product Overview
AC1MWBTQ (CAS 844652-50-2), with molecular formula C27H31N5O3 and molecular weight 473.24268 g/mol. IUPAC: 6-imino-13-methyl-2-oxo-N-(1-phenylethyl)-7-(3-propan-2-yloxypropyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.