CS-0082416
(S)-3-Amino-9-fluoro-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-one dihydrochloride
Manufacturer: ChemScene
CAS Number: 2243205-28-7
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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
C₉H₁₂Cl₂FN₃O
Molecular Weight
268.12
Synonyms
None
SMILES
N[C@H]1CNC2=CC=CC(F)=C2NC1=O.Cl.Cl
Tpsa
67.15
Logp
1.3606
H Acceptors
3
H Donors
3
Rotatable Bonds
0
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: C₉H₁₂Cl₂FN₃O
Molecular Weight: 268.12
Synonyms: None
SMILES: N[C@H]1CNC2=CC=CC(F)=C2NC1=O.Cl.Cl
Tpsa: 67.15
Logp: 1.3606
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂Cl₂FN₃O
Molecular Weight:
268.12
Synonyms:
None
SMILES:
N[C@H]1CNC2=CC=CC(F)=C2NC1=O.Cl.Cl
Tpsa:
67.15
Logp:
1.3606
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₉N₃O₃
Molecular Weight: 277.32
Synonyms: (S)-tert-butyl (2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]-[1,4]-diazepin-3-yl)-carbamate
SMILES: O=C(OC(C)(C)C)N[C@H]1CNC2=CC=CC=C2NC1=O
Tpsa: 79.46
Logp: 1.9439
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₉N₃O₃
Molecular Weight:
277.32
Synonyms:
(S)-tert-butyl (2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]-[1,4]-diazepin-3-yl)-carbamate
SMILES:
O=C(OC(C)(C)C)N[C@H]1CNC2=CC=CC=C2NC1=O
Tpsa:
79.46
Logp:
1.9439
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁NO₅
Molecular Weight: 225.20
Synonyms: None
SMILES: O=C(C1=C(O)C2=C(COC2)NC1=O)OCC
Tpsa: 88.62
Logp: 0.2874
H Acceptors: 5
H Donors: 2
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:
C₁₀H₁₁NO₅
Molecular Weight:
225.20
Synonyms:
None
SMILES:
O=C(C1=C(O)C2=C(COC2)NC1=O)OCC
Tpsa:
88.62
Logp:
0.2874
H Acceptors:
5
H Donors:
2
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: C₁₅H₂₁N₃O₃
Molecular Weight: 291.35
Synonyms: None
SMILES: O=C(OC(C)(C)C)N[C@H]1CNC2=CC=CC=C2N(C)C1=O
Tpsa: 70.67
Logp: 1.9682
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₁N₃O₃
Molecular Weight:
291.35
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N[C@H]1CNC2=CC=CC=C2N(C)C1=O
Tpsa:
70.67
Logp:
1.9682
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1