CS-1003155
1-(6-Amino-3,5-difluoro-2-pyridinyl)-8-chloro-7-fluoro-1,4-dihydro-6-(3-hydroxy-1-azetidinyl)-4-oxo-3-quinolinecarboxylic acid
Manufacturer: ChemScene
CAS Number: 2497737-45-6
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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
C₁₈H₁₂ClF₃N₄O₄
Molecular Weight
440.76
Synonyms
None
SMILES
O=C(O)C1=CN(C2=NC(N)=C(F)C=C2F)C=3C(Cl)=C(F)C(=CC3C1=O)N4CC(O)C4
Tpsa
121.68
Logp
1.9177
H Acceptors
7
H Donors
3
Rotatable Bonds
3
SAFETY INFORMATION
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: C₁₈H₁₂ClF₃N₄O₄
Molecular Weight: 440.76
Synonyms: None
SMILES: O=C(O)C1=CN(C2=NC(N)=C(F)C=C2F)C=3C(Cl)=C(F)C(=CC3C1=O)N4CC(O)C4
Tpsa: 121.68
Logp: 1.9177
H Acceptors: 7
H Donors: 3
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:
C₁₈H₁₂ClF₃N₄O₄
Molecular Weight:
440.76
Synonyms:
None
SMILES:
O=C(O)C1=CN(C2=NC(N)=C(F)C=C2F)C=3C(Cl)=C(F)C(=CC3C1=O)N4CC(O)C4
Tpsa:
121.68
Logp:
1.9177
H Acceptors:
7
H Donors:
3
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: C₃₃H₁₇Cl₂F₆N₇O₇
Molecular Weight: 808.43
Synonyms: None
SMILES: O=C(O)C1=CN(C2=NC(N)=C(F)C=C2F)C3=C(Cl)C(NC=4N=C(C(F)=CC4F)N5C=C(C(=O)O)C(=O)C6=CC(F)=C(C(Cl)=C65)N7CC(O)C7)=C(F)C=C3C1=O
Tpsa: 205.9
Logp: 5.1293
H Acceptors: 12
H Donors: 5
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₃H₁₇Cl₂F₆N₇O₇
Molecular Weight:
808.43
Synonyms:
None
SMILES:
O=C(O)C1=CN(C2=NC(N)=C(F)C=C2F)C3=C(Cl)C(NC=4N=C(C(F)=CC4F)N5C=C(C(=O)O)C(=O)C6=CC(F)=C(C(Cl)=C65)N7CC(O)C7)=C(F)C=C3C1=O
Tpsa:
205.9
Logp:
5.1293
H Acceptors:
12
H Donors:
5
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₃H₁₇Cl₂F₆N₇O₇
Molecular Weight: 808.43
Synonyms: None
SMILES: O=C(O)C1=CN(C2=NC(N)=C(F)C=C2F)C3=C(Cl)C(OC4CN(C5=C(F)C=C6C(=O)C(=CN(C7=NC(N)=C(F)C=C7F)C6=C5Cl)C(=O)O)C4)=C(F)C=C3C1=O
Tpsa: 208.89
Logp: 5.0546
H Acceptors: 12
H Donors: 4
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₃H₁₇Cl₂F₆N₇O₇
Molecular Weight:
808.43
Synonyms:
None
SMILES:
O=C(O)C1=CN(C2=NC(N)=C(F)C=C2F)C3=C(Cl)C(OC4CN(C5=C(F)C=C6C(=O)C(=CN(C7=NC(N)=C(F)C=C7F)C6=C5Cl)C(=O)O)C4)=C(F)C=C3C1=O
Tpsa:
208.89
Logp:
5.0546
H Acceptors:
12
H Donors:
4
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₇NO₄
Molecular Weight: 345.43
Synonyms: None
SMILES: O(C1=CC=C(C=C1OC)CCNCCC2=CC=C(OC)C(OC)=C2)C
Tpsa: 48.95
Logp: 3.0958
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₇NO₄
Molecular Weight:
345.43
Synonyms:
None
SMILES:
O(C1=CC=C(C=C1OC)CCNCCC2=CC=C(OC)C(OC)=C2)C
Tpsa:
48.95
Logp:
3.0958
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
10