CS-1001268
5-[(Hexahydro-1H-1,4-diazepin-1-yl)sulfonyl]quinoline
Manufacturer: ChemScene
CAS Number: 139390-45-7
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₄H₁₇N₃O₂S
Molecular Weight
291.37
Synonyms
None
SMILES
O=S(=O)(C1=CC=CC2=NC=CC=C21)N3CCNCCC3
Tpsa
62.3
Logp
1.2188
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₇N₃O₂S
Molecular Weight: 291.37
Synonyms: None
SMILES: O=S(=O)(C1=CC=CC2=NC=CC=C21)N3CCNCCC3
Tpsa: 62.3
Logp: 1.2188
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₇N₃O₂S
Molecular Weight:
291.37
Synonyms:
None
SMILES:
O=S(=O)(C1=CC=CC2=NC=CC=C21)N3CCNCCC3
Tpsa:
62.3
Logp:
1.2188
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₂N₆O₅
Molecular Weight: 354.36
Synonyms: None
SMILES: C(OC(COC([C@@H](C(C)C)N)=O)CO)N1C2=C(N=C1)C(=O)N=C(N)N2
Tpsa: 171.37
Logp: -1.4367
H Acceptors: 10
H Donors: 4
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₂N₆O₅
Molecular Weight:
354.36
Synonyms:
None
SMILES:
C(OC(COC([C@@H](C(C)C)N)=O)CO)N1C2=C(N=C1)C(=O)N=C(N)N2
Tpsa:
171.37
Logp:
-1.4367
H Acceptors:
10
H Donors:
4
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₆ClNO
Molecular Weight: 309.79
Synonyms: None
SMILES: C(=C/C1=CC(C(C)O)=CC=C1)\C2=NC3=C(C=C2)C=CC(Cl)=C3
Tpsa: 33.12
Logp: 5.1119
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₆ClNO
Molecular Weight:
309.79
Synonyms:
None
SMILES:
C(=C/C1=CC(C(C)O)=CC=C1)\C2=NC3=C(C=C2)C=CC(Cl)=C3
Tpsa:
33.12
Logp:
5.1119
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₅BrN₂O₃
Molecular Weight: 303.15
Synonyms: None
SMILES: O=C(OC)C1=NN(C(=C1Br)C)C2OCCCC2
Tpsa: 53.35
Logp: 2.43972
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₅BrN₂O₃
Molecular Weight:
303.15
Synonyms:
None
SMILES:
O=C(OC)C1=NN(C(=C1Br)C)C2OCCCC2
Tpsa:
53.35
Logp:
2.43972
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
2