CS-1002263
7-Fluoro-1,2-dihydro-8-[4-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]-1-piperazinyl]-5-oxo-5H-thiazolo[3,2-a]quinoline-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 187741-43-1
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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
C₂₁H₂₀FN₃O₆S
Molecular Weight
461.46
Synonyms
None
SMILES
O=C1OC(=C(O1)CN2CCN(C=3C=C4C(=CC3F)C(=O)C(C(=O)O)=C5SCCN54)CC2)C
Tpsa
109.13
Logp
2.12132
H Acceptors
9
H Donors
1
Rotatable Bonds
4
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: C₂₁H₂₀FN₃O₆S
Molecular Weight: 461.46
Synonyms: None
SMILES: O=C1OC(=C(O1)CN2CCN(C=3C=C4C(=CC3F)C(=O)C(C(=O)O)=C5SCCN54)CC2)C
Tpsa: 109.13
Logp: 2.12132
H Acceptors: 9
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₀FN₃O₆S
Molecular Weight:
461.46
Synonyms:
None
SMILES:
O=C1OC(=C(O1)CN2CCN(C=3C=C4C(=CC3F)C(=O)C(C(=O)O)=C5SCCN54)CC2)C
Tpsa:
109.13
Logp:
2.12132
H Acceptors:
9
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₂O₃
Molecular Weight: 156.18
Synonyms: None
SMILES: O=C(OCC)C=CC1OC1C
Tpsa: 38.83
Logp: 0.893
H Acceptors: 3
H Donors: 0
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:
C₈H₁₂O₃
Molecular Weight:
156.18
Synonyms:
None
SMILES:
O=C(OCC)C=CC1OC1C
Tpsa:
38.83
Logp:
0.893
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₆N₅O₄P
Molecular Weight: 371.37
Synonyms: None
SMILES: C([C@H](OCP(OCC)(OCC)=O)C)N1C=2C(=C(NCC)N=CN2)N=C1
Tpsa: 100.39
Logp: 2.8868
H Acceptors: 9
H Donors: 1
Rotatable Bonds: 11
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₆N₅O₄P
Molecular Weight:
371.37
Synonyms:
None
SMILES:
C([C@H](OCP(OCC)(OCC)=O)C)N1C=2C(=C(NCC)N=CN2)N=C1
Tpsa:
100.39
Logp:
2.8868
H Acceptors:
9
H Donors:
1
Rotatable Bonds:
11
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₂N₅O₄P
Molecular Weight: 343.32
Synonyms: None
SMILES: N(C[C@H](OCP(OCC)(OCC)=O)C)C1=C2C(=NC=N1)N=CN2
Tpsa: 111.25
Logp: 2.3935
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 10
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₂N₅O₄P
Molecular Weight:
343.32
Synonyms:
None
SMILES:
N(C[C@H](OCP(OCC)(OCC)=O)C)C1=C2C(=NC=N1)N=CN2
Tpsa:
111.25
Logp:
2.3935
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
10