Chemical ID: 4119924

c1cc(sc1)CNc2ccc(cc2)O
Chemical ID:
4119924
Name [?]:
4-(2-thienylmethylamino)phenol
SMILES [?]:
c1cc(sc1)CNc2ccc(cc2)O
InChi [?]:
InChI=1/C11H11NOS/c13-10-5-3-9(4-6-10)12-8-11-2-1-7-14-11/h1-7,12-13H,8H2
InChi Info:
AuxInfo=1/0/N:1,2,9,13,10,12,5,6,8,11,3,7,14,4/E:(3,4)(5,6)/rA:14nCCCSCCNCCCCCCO/rB:s1;d2;s3;d1s4;s3;s6;s7;s8;d9;s10;d11;d8s12;s11;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H11NOS
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.56266
Area:388.659
Solvation:-2.15381
Coulombic:-29.2833
Bond Count [?]
All:15
Single:10
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:205.277
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.61
LogP (Chemaxon):2.53

Name Annotations

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Descriptor Annotations

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