AC1M20WT

3-(4-ethylphenyl)-1-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2,4-dione

Also Known As: F1601-0576|3-(4-ethylphenyl)-1-(3-nitrobenzyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione|3-(4-ethylphenyl)-1-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2,4-dione|4-(4-ethylphenyl)-6-[(3-nitrophenyl)methyl]-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7)-diene-3,5-dione|3-(4-ethylphenyl)-1-(3-nitrobenzyl)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione

Molecular Formula	C25H23N3O4S
Molecular Weight	461.14093 g/mol
LogP	4.6116
Topological Polar Surface Area	87.14 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	461.14093
Monoisotopic Mass	461.14093
Heavy Atoms	33
Complexity	1495.3485

Chemical Identifiers

CAS Number	866015-85-2
SMILES	CCC1=CC=C(C=C1)N2C(=O)C3=C(N(C2=O)CC4=CC(=CC=C4)[N+](=O)[O-])SC5=C3CCCC5