AC1L9E6J
4-[[3-[[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methyl]-2-(3-fluorophenyl)-1,3-diazinan-1-yl]methyl]-N,N-bis(2-chloroethyl)-3-methylaniline
Also Known As: 4-[[3-[[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methyl]-2-(3-fluorophenyl)-1,3-diazinan-1-yl]methyl]-N,N-bis(2-chloroethyl)-3-methylaniline|4,4'-{[2-(3-Fluorophenyl)-1,3-diazinane-1,3-diyl]bis(methylene)}bis[N,N-bis(2-chloroethyl)-3-methylaniline]|Benzenamine,4,4-[[2-(3-fluorophenyl)dihydro-1,3(2h,4h)-pyrimidinediyl]bis(methylene)]bis[n,n-bis(2-chloroethyl)-3-methyl-(9ci)
| Molecular Formula | C34H43Cl4FN4 |
|---|---|
| Molecular Weight | 666.2226 g/mol |
| LogP | 8.5 |
| Topological Polar Surface Area | 13.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 666.2226 |
| Monoisotopic Mass | 666.2226 |
| Heavy Atoms | 43 |
| Complexity | 721.0 |
Chemical Identifiers
| CAS Number | 19320-32-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCCl)CCCl)CN2CCCN(C2C3=CC(=CC=C3)F)CC4=C(C=C(C=C4)N(CCCl)CCCl)C |
| InChIKey | ZJJNIWFEXNZLAF-UHFFFAOYSA-N |
Product Overview
AC1L9E6J (CAS 19320-32-2), with molecular formula C34H43Cl4FN4 and molecular weight 666.2226 g/mol. IUPAC: 4-[[3-[[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methyl]-2-(3-fluorophenyl)-1,3-diazinan-1-yl]methyl]-N,N-bis(2-chloroethyl)-3-methylaniline.