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]+ 329.143046 173.3
[M+Na]+ 351.124988 179.4
[M-H]- 327.128494 176.3
[M+NH4]+ 346.169593 187.2
[M+K]+ 367.098928 174.9
[M+H-H2O]+ 311.133030 164.2
[M+HCOO]- 373.133971 187.5
[M+CH3COO]- 387.149621 182.8
[M+Na-2H]- 349.110436 178.7
[M]+ 328.13522142 176.0
[M]- 328.13631858 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.