1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine

C13H28N4O4S2 — CID 22326506

IUPAC1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine
SMILESO=S1(=O)CCN(CCCNNCCN2CCS(=O)(=O)CC2)CC1
InChIInChI=1S/C13H28N4O4S2/c18-22(19)10-6-16(7-11-22)4-1-2-14-15-3-5-17-8-12-23(20,21)13-9-17/h14-15H,1-13H2
InChIKeyRIOGBKBBMBZTDW-UHFFFAOYSA-N
MW368.53 g/mol
LogP-2.07
Rot. Bonds8

About 1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine

1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine (PubChem CID 22326506) has the molecular formula C13H28N4O4S2 and a molecular weight of 368.53 g/mol. Its IUPAC name is 1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine.

Molecular Properties

Compound Name1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine
PubChem CID22326506
Molecular FormulaC13H28N4O4S2
Molecular Weight368.53 g/mol
Exact Mass368.16
IUPAC Name1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine
SMILESO=S1(=O)CCN(CCCNNCCN2CCS(=O)(=O)CC2)CC1
InChIInChI=1S/C13H28N4O4S2/c18-22(19)10-6-16(7-11-22)4-1-2-14-15-3-5-17-8-12-23(20,21)13-9-17/h14-15H,1-13H2
InChIKeyRIOGBKBBMBZTDW-UHFFFAOYSA-N
XLogP-2.07
TPSA98.82 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.53
LogP ≤ 5-2.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(1,1-dioxo-1,4-thiazinan-4-yl)-N-methylbutan-1-amine
CID 60840838
4-butyl-1,4-thiazinane 1,1-dioxide;ethane
CID 143865715
N-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-3,3-dimethylbutan-1-amine
CID 62560247
N-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]propanamide
CID 90276982
11-(1,1-dioxo-1,4-thiazinan-4-yl)undecanoic acid
CID 12524103
N-[2-(1,1-dioxo-1,4-thiazepan-4-yl)ethyl]pentan-3-amine
CID 114083776
N-[2-(1,1-dioxo-1,4-thiazepan-4-yl)ethyl]cyclohexanamine
CID 113240998
1-(3-bicyclo[3.3.1]nonanyl)-3-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]urea
CID 167956442
5-(1,1-dioxo-1,4-thiazinan-4-yl)-2,2-dimethylpentan-1-amine
CID 65254132
7-chloro-N-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]-8-methylquinolin-2-amine
CID 133433966
3-(1,1-dioxo-1,4-thiazinan-4-yl)propanenitrile
CID 24728598
3-cyclopropyl-N-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]-1,2,4-thiadiazol-5-amine
CID 133434429

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine?
The IUPAC name of 1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine (CID 22326506) is 1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine.
What is the SMILES notation for 1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine?
The canonical SMILES for 1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine is O=S1(=O)CCN(CCCNNCCN2CCS(=O)(=O)CC2)CC1.
What is the InChIKey of 1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine?
The InChIKey is RIOGBKBBMBZTDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N4O4S2/c18-22(19)10-6-16(7-11-22)4-1-2-14-15-3-5-17-8-12-23(20,21)13-9-17/h14-15H,1-13H2.
What are the key properties of 1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine?
1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine has a molecular weight of 368.53 g/mol, XLogP of -2.07, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-[3-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]hydrazine is sourced from PubChem (CID 22326506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).