CID 3048177

10h-pyrido(3,2-b)(1,4)benzothiazine-10-carboxamide, n-(3-(dimethylamino)propyl)-, hydrochloride

Structural Information

Molecular Formula
C17H20N4OS
SMILES
CN(C)CCCNC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3
InChI
InChI=1S/C17H20N4OS/c1-20(2)12-6-11-19-17(22)21-13-7-3-4-8-14(13)23-15-9-5-10-18-16(15)21/h3-5,7-10H,6,11-12H2,1-2H3,(H,19,22)
InChIKey
CZWKKYARBUZRNO-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]pyrido[3,2-b][1,4]benzothiazine-10-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

328.13577 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.14305 173.3
[M+Na]+ 351.12499 179.4
[M-H]- 327.12849 176.3
[M+NH4]+ 346.16959 187.2
[M+K]+ 367.09893 174.9
[M+H-H2O]+ 311.13303 164.2
[M+HCOO]- 373.13397 187.5
[M+CH3COO]- 387.14962 182.8
[M+Na-2H]- 349.11044 178.7
[M]+ 328.13522 176.0
[M]- 328.13632 176.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.