Chemical ID: 6396617

c1cc(sc1)C(=O)Nc2ccc(cc2Br)Br
Chemical ID:
6396617
Name [?]:
N-(2,4-dibromophenyl)thiophene-2-carboxamide
SMILES [?]:
c1cc(sc1)C(=O)Nc2ccc(cc2Br)Br
InChi [?]:
InChI=1/C11H7Br2NOS/c12-7-3-4-9(8(13)6-7)14-11(15)10-2-1-5-16-10/h1-6H,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,2,11,10,5,13,12,14,9,3,6,16,15,8,7,4/rA:16nCCCSCCONCCCCCCBrBr/rB:s1;d2;s3;d1s4;s3;d6;s6;s8;s9;d10;s11;d12;d9s13;s14;s12;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H7Br2NOS
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:9.47376
Area:428.909
Solvation:-1.24897
Coulombic:-23.6517
Bond Count [?]
All:17
Single:11
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:361.053
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.61
LogP (Chemaxon):3.45

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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