C27H31N4O4.ClO4

N-[2-[2-[(5-acetamido-3-ethyl-1,3-benzoxazol-3-ium-2-yl)methylidene]butylidene]-3-ethyl-1,3-benzoxazol-5-yl]acetamide perchlorate

Also Known As: EINECS 269-461-5|Benzoxazolium, 5-(acetylamino)-2-[2-[[5-(acetylamino)-3-ethyl-2(3H)-benzoxazolylidene]methyl]-1-butenyl]-3-ethyl-, perchlorate|2-(2-Ethyl-3-(5-(acetylamino)-3-ethylbenzoxazolinylidene)propenyl-5-(acetylamino)-3-ethylbenzoxazolium perchlorate|5-(ACETAMIDO)-2-[2-[[5-(ACETAMIDO)-3-ETHYL-3H-BENZOXAZOL-2-YLIDENE]METHYL]BUT-1-ENYL]-3-ETHYLBENZOXAZOLIUM PERCHLORATE|Benzoxazolium, 5-(acetylamino)-2-(2-((5-(acetylamino)-3-ethyl-2(3H)-benzoxazolylidene)methyl)-1-buten-1-yl)-3-ethyl-, perchlorate (1:1)|Benzoxazolium, 5-(acetylamino)-2-(2-((5-(acetylamino)-3-ethyl-2(3H)-benzoxazolylidene)methyl)-1-butenyl)-3-ethyl-, perchlorate

Molecular Formula	C27H31ClN4O8
Molecular Weight	574.18304 g/mol
LogP	0.45
Topological Polar Surface Area	179.93 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	9
Rotatable Bonds	7
Exact Mass	574.18304
Heavy Atoms	40
Complexity	1452.7

Chemical Identifiers

CAS Number	68239-68-9
SMILES	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)NC(=O)C)CC)C=C3N(C4=C(O3)C=CC(=C4)NC(=O)C)CC.[O-]Cl(=O)(=O)=O