AC1NES3G

ethyl 15-[(4,5-dibromothiophene-2-carbonyl)amino]-14-thiabicyclo[11.3.0]hexadeca-1(13),15-diene-16-carboxylate

Also Known As: Ethyl 2-(4,5-dibromothiophene-2-carboxamido)-5,6,7,8,9,10,11,12,13,14-decahydro-4H-cyclotrideca[b]thiophene-3-carboxylate|ethyl 15-[(4,5-dibromothiophene-2-carbonyl)amino]-14-thiabicyclo[11.3.0]hexadeca-1(13),15-diene-16-carboxylate|ethyl 2-[(4,5-dibromo-2-thienyl)carbonylamino]-4,5,6,7,8,9,10,11,12,13,14-unde cahydrocyclotrideca[2,1-b]thiophene-3-carboxylate|ethyl 2-{[(4,5-dibromothiophen-2-yl)carbonyl]amino}-5,6,7,8,9,10,11,12,13,14-decahydro-4H-cyclotrideca[b]thiophene-3-carboxylate

Molecular Formula	C23H29Br2NO3S2
Molecular Weight	588.99554 g/mol
LogP	8.3731
Topological Polar Surface Area	55.4 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	588.99554
Monoisotopic Mass	590.9935
Heavy Atoms	31
Complexity	887.51404

Chemical Identifiers

CAS Number	438232-08-7
SMILES	CCOC(=O)C1=C(SC2=C1CCCCCCCCCCC2)NC(=O)C3=CC(=C(S3)Br)Br